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Screening compounds

AC1Nsods

Also known as methyl (2Z)-5-(2-chlorophenyl)-2-[(2-methoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, methyl (2Z)-5-(2-chlorophenyl)-2-(2-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, (Z)-methyl 5-(2-chlorophenyl)-2-(2-methoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate

CAS 5875-76-3Formula C23H19ClN2O4SMolar mass 454.94 g/mol
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AC1Nsods chemical structure, C23H19ClN2O4S, CAS 5875-76-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
5875-76-3
Formula
C23H19ClN2O4S
Molar mass
454.94 g/mol
HS code
293499
Category
Screening compounds

What is AC1Nsods?

Plain description, key identifiers and synonyms

AC1Nsods is a chemical substance with the molecular formula C23H19ClN2O4S and a molar mass of 454.94 g/mol. Its CAS registry number is 5875-76-3. The IUPAC name is methyl (2Z)-5-(2-chlorophenyl)-2-[(2-methoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
methyl (2Z)-5-(2-chlorophenyl)-2-[(2-methoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
CAS number
5875-76-3 CAS number cross-checked
Molecular formula
C23H19ClN2O4S
InChIKey
JSLHKRFTOSCCNN-PDGQHHTCSA-N
InChI
InChI=1S/C23H19ClN2O4S/c1-13-19(22(28)30-3)20(15-9-5-6-10-16(15)24)26-21(27)18(31-23(26)25-13)12-14-8-4-7-11-17(14)29-2/h4-12,20H,1-3H3/b18-12-
Canonical SMILES
COC(=O)C1=C(C)N=c2sc(=Cc3ccccc3OC)c(=O)n2C1c1ccccc1Cl
Isomeric SMILES
CC1=C(C(N2C(=O)/C(=C/C3=CC=CC=C3OC)/SC2=N1)C4=CC=CC=C4Cl)C(=O)OC

Synonyms

  • methyl (2Z)-5-(2-chlorophenyl)-2-[(2-methoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
  • methyl (2Z)-5-(2-chlorophenyl)-2-(2-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
  • (Z)-methyl 5-(2-chlorophenyl)-2-(2-methoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
  • Methyl (2Z)-5-(2-chlorophenyl)-2-[(2-methoxyphenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
  • methyl 5-(2-chlorophenyl)-2-(2-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

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
454.94 g/molcalc.
Exact mass
454.0754 Dacalc.
LogP (octanol/water)
3.07calc.
Topological polar surface area
69.89 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
4calc.
Heavy atoms
31calc.
Rings
4calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.17calc.
Formal charge
0calc.
Stereocentres
1calc.
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=c1c(=Cc2ccccc2)sc2n1C(c1ccccc1)C=CN=2

O=c1c(=Cc2ccccc2)sc2n1C(c1ccccc1)C=CN=2

4 rings, 23 atoms.

410 other chemicals share 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.

AC1Nsods suppliers

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AC1Nsods 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 AC1Nsods is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

The HS code shown for AC1Nsods is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about AC1Nsods, based on the data on this page

What is AC1Nsods?

AC1Nsods is a chemical substance with the molecular formula C23H19ClN2O4S and a molar mass of 454.94 g/mol. Its CAS registry number is 5875-76-3. The IUPAC name is methyl (2Z)-5-(2-chlorophenyl)-2-[(2-methoxyphenyl)methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.

What is the CAS number of AC1Nsods?

The CAS registry number of AC1Nsods is 5875-76-3.

What is the molecular formula and weight of AC1Nsods?

The molecular formula of AC1Nsods is C23H19ClN2O4S and its molar mass is 454.94 g/mol.

What is AC1Nsods used for?

Known uses and roles of AC1Nsods include building blocks in research and laboratory and screening compounds in research and laboratory.

Is AC1Nsods hazardous?

No GHS hazard classification for AC1Nsods 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 AC1Nsods?

AC1Nsods is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy AC1Nsods?

Post a free request on CompoundList and suppliers of AC1Nsods will send you quotes. Your contact details stay private until you accept a quote.

What is the price of AC1Nsods?

Suppliers quote AC1Nsods 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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