6-[(3-carbamoyl-4,5-dihydronaphtho[1,2-b]thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-[(3-carbamoyl-4,5-dihydronaphtho[1,2-b]thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
6-[(3-carbamoyl-4,5-dihydronaphtho[1,2-b]thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | Y205-6763 |
| Compound Name: | 6-[(3-carbamoyl-4,5-dihydronaphtho[1,2-b]thiophen-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 396.46 |
| Molecular Formula: | C21 H20 N2 O4 S |
| Smiles: | C1C=CCC(C1C(O)=O)C(Nc1c(C(N)=O)c2CCc3ccccc3c2s1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.2001 |
| logD: | -0.1557 |
| logSw: | -3.1824 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 85.432 |
| InChI Key: | BNIADBZZTPKISR-UHFFFAOYSA-N |