CID9931059
7-(benzylcarbamoyl)-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid
Also Known As: 2-[(Carboxycarbonyl)amino]-4,7-dihydro-7-[[(phenylmethyl)amino]carbonyl]-5h-thieno[2,3-c]pyran-3-carboxylic acid|5-(benzylcarbamoyl)-8-(oxaloamino)-4-oxa-7-thiabicyclo[4.3.0]nona-8,10-diene-9-carboxylic Acid
CAS: 330191-35-0
| Molecular Formula | C18H16N2O7S |
|---|---|
| Molecular Weight | 404.0678 g/mol |
| LogP | 1.3996 |
| Topological Polar Surface Area | 142.03 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 404.0678 |
| Monoisotopic Mass | 404.0678 |
| Heavy Atoms | 28 |
| Complexity | 938.9108 |
Chemical Identifiers
| CAS Number | 330191-35-0 |
|---|---|
| SMILES | C1COC(C2=C1C(=C(S2)NC(=O)C(=O)O)C(=O)O)C(=O)NCC3=CC=CC=C3 |
Product Overview
CID9931059 (CAS 330191-35-0), with molecular formula C18H16N2O7S and molecular weight 404.0678 g/mol. IUPAC: 7-(benzylcarbamoyl)-2-(oxaloamino)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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