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Screening compounds

Vulolisib

Also known as (2S)-2-[[2-[(4R)-4-(difluoromethyl)-2-oxo-1,3-thiazolidin-3-yl]-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin-9-yl]amino]propanamide, (2S)-2-((2-((4R)-4-(Difluoromethyl)-2-oxo-1,3- thiazolidin-2-yl)-5,6-dihydroimidazo(1,2- d)(1,4)benzoxazepin-9-yl)amino)propanamide, Propanamide, 2-((2-((4R)-4-(difluoromethyl)-2-oxo-3-thiazolidinyl)-5,6-dihydroimidazo(1,2-d)(1,4)benzoxazepin-9-yl)amino)-, (2S)-

CAS 2390105-79-8Formula C18H19F2N5O3SMolar mass 423.45 g/mol
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Vulolisib chemical structure, C18H19F2N5O3S, CAS 2390105-79-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2390105-79-8
Formula
C18H19F2N5O3S
Molar mass
423.45 g/mol
HS code
293410
Category
Screening compounds

What is Vulolisib?

Plain description, key identifiers and synonyms

Vulolisib is a chemical substance with the molecular formula C18H19F2N5O3S and a molar mass of 423.45 g/mol. Its CAS registry number is 2390105-79-8. The IUPAC name is (2S)-2-[[2-[(4R)-4-(difluoromethyl)-2-oxo-1,3-thiazolidin-3-yl]-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin-9-yl]amino]propanamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S)-2-[[2-[(4R)-4-(difluoromethyl)-2-oxo-1,3-thiazolidin-3-yl]-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin-9-yl]amino]propanamide
CAS number
2390105-79-8
Molecular formula
C18H19F2N5O3S
UNII
FTP96R76VB
InChIKey
KEEKMOIRJUWKNK-CABZTGNLSA-N
InChI
InChI=1S/C18H19F2N5O3S/c1-9(16(21)26)22-10-2-3-11-13(6-10)28-5-4-24-7-14(23-17(11)24)25-12(15(19)20)8-29-18(25)27/h2-3,6-7,9,12,15,22H,4-5,8H2,1H3,(H2,21,26)/t9-,12-/m0/s1
Canonical SMILES
CC(Nc1ccc2c(c1)OCCn1cc(N3C(=O)SCC3C(F)F)nc1-2)C(N)=O
Isomeric SMILES
C[C@@H](C(=O)N)NC1=CC2=C(C=C1)C3=NC(=CN3CCO2)N4[C@@H](CSC4=O)C(F)F

Synonyms

  • (2S)-2-[[2-[(4R)-4-(difluoromethyl)-2-oxo-1,3-thiazolidin-3-yl]-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin-9-yl]amino]propanamide
  • (2S)-2-((2-((4R)-4-(Difluoromethyl)-2-oxo-1,3- thiazolidin-2-yl)-5,6-dihydroimidazo(1,2- d)(1,4)benzoxazepin-9-yl)amino)propanamide
  • Propanamide, 2-((2-((4R)-4-(difluoromethyl)-2-oxo-3-thiazolidinyl)-5,6-dihydroimidazo(1,2-d)(1,4)benzoxazepin-9-yl)amino)-, (2S)-
  • (2S)-2-({2-[(4R)-4-(difluoromethyl)-2-oxo-1,3- thiazolidin-2-yl]-5,6-dihydroimidazo[1,2- d][1,4]benzoxazepin-9-yl}amino)propanamide
  • Propanamide, 2-[[2-[(4R)-4-(difluoromethyl)-2-oxo-3-thiazolidinyl]-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin-9-yl]amino]-, (2S)-
  • Example 22

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
423.45 g/molcalc.
Exact mass
423.1177 Dacalc.
LogP (octanol/water)
2.54calc.
Topological polar surface area
102.5 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
5calc.
Heavy atoms
29calc.
Rings
4calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.39calc.
Formal charge
0calc.
Stereocentres
2calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=C1SCCN1c1cn2c(n1)-c1ccccc1OCC2

O=C1SCCN1c1cn2c(n1)-c1ccccc1OCC2

4 rings, 20 atoms.

No other chemical in our database has this scaffold.

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Vulolisib suppliers

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Vulolisib price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Roles

  • antineoplastic agent
  • pharmaceutical

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Vulolisib is traded under.

HS 2934.10Indicative HS code

Compounds containing an unfused thiazole ring (whether or not hydrogenated) in the…

World exports in 2024
$3.88B
−16.1% vs 2023, imports $3.12B
2019 to 2024
Top exporters
  1. Switzerland * partner reported36.4%
  2. Ireland28.8%
  3. China10.0%
Top importers
  1. Canada33.4%
  2. United States14.4%
  3. Ireland13.1%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Vulolisib is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Vulolisib, based on the data on this page

What is Vulolisib?

Vulolisib is a chemical substance with the molecular formula C18H19F2N5O3S and a molar mass of 423.45 g/mol. Its CAS registry number is 2390105-79-8. The IUPAC name is (2S)-2-[[2-[(4R)-4-(difluoromethyl)-2-oxo-1,3-thiazolidin-3-yl]-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin-9-yl]amino]propanamide.

What is the CAS number of Vulolisib?

The CAS registry number of Vulolisib is 2390105-79-8.

What is the molecular formula and weight of Vulolisib?

The molecular formula of Vulolisib is C18H19F2N5O3S and its molar mass is 423.45 g/mol.

What is Vulolisib used for?

Known uses and roles of Vulolisib include building blocks in research and laboratory, screening compounds in research and laboratory, antineoplastic agent and pharmaceutical.

Is Vulolisib hazardous?

No GHS hazard classification for Vulolisib is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Vulolisib?

Vulolisib is usually classified under HS code 293410 (Compounds containing an unfused thiazole ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Vulolisib?

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What is the price of Vulolisib?

Suppliers quote Vulolisib on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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