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Screening compounds

Mal-C2-fapi

CAS 2929316-59-4Formula C30H31F2N7O6Molar mass 623.62 g/mol
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Mal-C2-fapi chemical structure, C30H31F2N7O6, CAS 2929316-59-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2929316-59-4
Formula
C30H31F2N7O6
Molar mass
623.62 g/mol
HS code
293359
Category
Screening compounds

What is Mal-C2-fapi?

Plain description, key identifiers and synonyms

Mal-C2-fapi is a chemical substance with the molecular formula C30H31F2N7O6 and a molar mass of 623.62 g/mol. Its CAS registry number is 2929316-59-4. The IUPAC name is N-[2-[(2R)-2-cyano-4,4-difluoropyrrolidin-1-yl]-2-oxoethyl]-6-[3-[4-[2-(2,5-dioxopyrrol-1-yl)acetyl]piperazin-1-yl]propoxy]quinoline-4-carboxamide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
N-[2-[(2R)-2-cyano-4,4-difluoropyrrolidin-1-yl]-2-oxoethyl]-6-[3-[4-[2-(2,5-dioxopyrrol-1-yl)acetyl]piperazin-1-yl]propoxy]quinoline-4-carboxamide
CAS number
2929316-59-4
Molecular formula
C30H31F2N7O6
InChIKey
UVPRMUPZNRFOFW-HXUWFJFHSA-N
InChI
InChI=1S/C30H31F2N7O6/c31-30(32)15-20(16-33)39(19-30)27(42)17-35-29(44)22-6-7-34-24-3-2-21(14-23(22)24)45-13-1-8-36-9-11-37(12-10-36)28(43)18-38-25(40)4-5-26(38)41/h2-7,14,20H,1,8-13,15,17-19H2,(H,35,44)/t20-/m1/s1
Canonical SMILES
N#CC1CC(F)(F)CN1C(=O)CNC(=O)c1ccnc2ccc(OCCCN3CCN(C(=O)CN4C(=O)C=CC4=O)CC3)cc12
Isomeric SMILES
C1CN(CCN1CCCOC2=CC3=C(C=CN=C3C=C2)C(=O)NCC(=O)N4CC(C[C@@H]4C#N)(F)F)C(=O)CN5C(=O)C=CC5=O

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
623.62 g/molcalc.
Exact mass
623.2304 Dacalc.
LogP (octanol/water)
0.56calc.
Topological polar surface area
156.3 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
9calc.
Rotatable bonds
10calc.
Heavy atoms
45calc.
Rings
5calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.43calc.
Formal charge
0calc.
Stereocentres
1calc.
Lipinski rule of five
Passes (1 violation)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=C(NCC(=O)N1CCCC1)c1ccnc2ccc(OCCCN3CCN(C(=O)CN4C(=O)C=CC4=O)CC3)cc12

O=C(NCC(=O)N1CCCC1)c1ccnc2ccc(OCCCN3CCN(C(=O)CN4C(=O)C=CC4=O)CC3)cc12

5 rings, 41 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.

Mal-C2-fapi suppliers

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Mal-C2-fapi price

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Uses and applications

What the substance is used for, by industry and function

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 Mal-C2-fapi is traded under.

HS 2933.59Indicative HS code

Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring, other

World exports in 2024
$18.4B
+10.5% vs 2023, imports $24.8B
2019 to 2024
Top exporters
  1. Ireland43.6%
  2. Switzerland * partner reported26.3%
  3. China7.9%
Top importers
  1. Slovenia30.3%
  2. United States30.1%
  3. Germany15.3%

* Partner reported figures, a lower bound.

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

The HS code shown for Mal-C2-fapi is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Mal-C2-fapi, based on the data on this page

What is Mal-C2-fapi?

Mal-C2-fapi is a chemical substance with the molecular formula C30H31F2N7O6 and a molar mass of 623.62 g/mol. Its CAS registry number is 2929316-59-4. The IUPAC name is N-[2-[(2R)-2-cyano-4,4-difluoropyrrolidin-1-yl]-2-oxoethyl]-6-[3-[4-[2-(2,5-dioxopyrrol-1-yl)acetyl]piperazin-1-yl]propoxy]quinoline-4-carboxamide.

What is the CAS number of Mal-C2-fapi?

The CAS registry number of Mal-C2-fapi is 2929316-59-4.

What is the molecular formula and weight of Mal-C2-fapi?

The molecular formula of Mal-C2-fapi is C30H31F2N7O6 and its molar mass is 623.62 g/mol.

What is Mal-C2-fapi used for?

Known uses and roles of Mal-C2-fapi include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Mal-C2-fapi hazardous?

No GHS hazard classification for Mal-C2-fapi 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 Mal-C2-fapi?

Mal-C2-fapi is usually classified under HS code 293359 (Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Mal-C2-fapi?

Post a free request on CompoundList and suppliers of Mal-C2-fapi will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Mal-C2-fapi?

Suppliers quote Mal-C2-fapi 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

Practical guides that help when you source, ship or handle Mal-C2-fapi

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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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