N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-chloro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-chloro-1-benzothiophene-2-carboxamide
N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-chloro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 4402-0330 |
| Compound Name: | N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-chloro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 418.9 |
| Molecular Formula: | C23 H15 Cl N2 O2 S |
| Smiles: | Cc1c(cccc1NC(c1c(c2ccccc2s1)[Cl])=O)c1nc2ccccc2o1 |
| Stereo: | ACHIRAL |
| logP: | 6.5041 |
| logD: | 6.504 |
| logSw: | -6.3378 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.189 |
| InChI Key: | BEGRLSDVKJYGKR-UHFFFAOYSA-N |