AC1LXGRJ
3-[5-[(E)-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid
Also Known As: A2694/0114716|SR-01000090773-1|(E)-3-(5-((2-imino-4-oxo-3-(thiazol-2-yl)thiazolidin-5-ylidene)methyl)furan-2-yl)benzoic acid|3-(5-{(E)-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)benzoic acid|3-(5-{[(5E)-2-IMINO-4-OXO-3-(1,3-THIAZOL-2-YL)-1,3-THIAZOLIDIN-5-YLIDENE]METHYL}FURAN-2-YL)BENZOIC ACID|3-[5-[(E)-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid
| Molecular Formula | C18H11N3O4S2 |
|---|---|
| Molecular Weight | 397.0191 g/mol |
| LogP | 4.15697 |
| Topological Polar Surface Area | 107.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.0191 |
| Monoisotopic Mass | 397.0191 |
| Heavy Atoms | 27 |
| Complexity | 1085.7391 |
Chemical Identifiers
| CAS Number | 461663-18-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(=O)O)C2=CC=C(O2)/C=C/3\C(=O)N(C(=N)S3)C4=NC=CS4 |
Product Overview
AC1LXGRJ (CAS 461663-18-3), with molecular formula C18H11N3O4S2 and molecular weight 397.0191 g/mol. IUPAC: 3-[5-[(E)-[2-imino-4-oxo-3-(1,3-thiazol-2-yl)-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]benzoic acid.
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