Ataciguat
5-chloro-2-[(5-chlorothiophen-2-yl)sulfonylamino]-N-(4-morpholin-4-ylsulfonylphenyl)benzamide
Also Known As: Ataciguat|Ataciguat [INN]|ataciguatum|Ataciguat?|HMR-1766|HMR 1766|HMR1766|ATACIGUAT [WHO-DD]|GTPL5141|Tox21_113203|EX-A11166|Tox21_113203_1|NCGC00249417-01|NCGC00249417-02|SID:318165654|5-Chloro-2-(5-chlorothiophene-2-sulfonylamino)-N-(4-(morpholine-4-sulfonyl)phenyl)benzamide|CAS-254877-67-3|J3.164.183G|5-Chloro-2-(5-chlorothiophene-2-sulfonamido)-N-(4-(morpholinosulfonyl)phenyl)benzamide|5-chloro-2-[(5-chlorothiophen-2-yl)sulfonylamino]-N-(4-morpholin-4-ylsulfonylphenyl)benzamide
| Molecular Formula | C21H19Cl2N3O6S3 |
|---|---|
| Molecular Weight | 574.9813 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 167.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 574.9813 |
| Monoisotopic Mass | 574.9813 |
| Heavy Atoms | 35 |
| Complexity | 944.0 |
Chemical Identifiers
| CAS Number | 30804-69-4 |
|---|---|
| SMILES | C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)Cl)NS(=O)(=O)C4=CC=C(S4)Cl |
| InChIKey | PQHLRGARXNPFCF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ataciguat (CAS 30804-69-4), with molecular formula C21H19Cl2N3O6S3 and molecular weight 574.9813 g/mol. IUPAC: 5-chloro-2-[(5-chlorothiophen-2-yl)sulfonylamino]-N-(4-morpholin-4-ylsulfonylphenyl)benzamide.
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