CBMicro_046844
3-[(3-carbamoyl-4,5-dimethylthiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: CBMicro_046844|BIM-0046831.P001|3-[(3-carbamoyl-4,5-dimethylthiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid|AK-968/12117019|SR-01000228674-1|3-({[3-(AMINOCARBONYL)-4,5-DIMETHYL-2-THIENYL]AMINO}CARBONYL)BICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID|bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-[[[3-(aminocarbonyl)-4,5-dimethyl-2-thienyl]amino]carbonyl]-|2-[(3-carbamoyl-4,5-dimethylthiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-3-carboxylic acid|3-([[3-(AMINOCARBONYL)-4,5-DIMETHYL-2-THIENYL]AMINO]CARBONYL)BICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID
| Molecular Formula | C16H18N2O4S |
|---|---|
| Molecular Weight | 334.09872 g/mol |
| LogP | 1.92524 |
| Topological Polar Surface Area | 109.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 334.09872 |
| Monoisotopic Mass | 334.09872 |
| Heavy Atoms | 23 |
| Complexity | 736.68384 |
Chemical Identifiers
| CAS Number | 473446-88-7 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)N)NC(=O)C2C3CC(C2C(=O)O)C=C3)C |
Product Overview
CBMicro_046844 (CAS 473446-88-7), with molecular formula C16H18N2O4S and molecular weight 334.09872 g/mol. IUPAC: 3-[(3-carbamoyl-4,5-dimethylthiophen-2-yl)carbamoyl]bicyclo[2.2.1]hept-5-ene-2-carboxylic acid.
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