2-[(3-cyano-4,5-dimethylthiophen-2-yl)carbamoyl]benzoic acid
Chemical Structure Depiction of
2-[(3-cyano-4,5-dimethylthiophen-2-yl)carbamoyl]benzoic acid
2-[(3-cyano-4,5-dimethylthiophen-2-yl)carbamoyl]benzoic acid
Compound characteristics
| Compound ID: | 0988-0328 |
| Compound Name: | 2-[(3-cyano-4,5-dimethylthiophen-2-yl)carbamoyl]benzoic acid |
| Molecular Weight: | 300.33 |
| Molecular Formula: | C15 H12 N2 O3 S |
| Smiles: | Cc1c(C#N)c(NC(c2ccccc2C(O)=O)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 2.4737 |
| logD: | -1.9691 |
| logSw: | -2.8811 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.588 |
| InChI Key: | KDDSFSOYTBBKRM-UHFFFAOYSA-N |