N-(3-chloro-4-fluorophenyl)-5-[(ethanesulfonyl)(methyl)amino]-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-5-[(ethanesulfonyl)(methyl)amino]-1-benzothiophene-2-carboxamide
N-(3-chloro-4-fluorophenyl)-5-[(ethanesulfonyl)(methyl)amino]-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | J019-0247 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-5-[(ethanesulfonyl)(methyl)amino]-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 426.91 |
| Molecular Formula: | C18 H16 Cl F N2 O3 S2 |
| Smiles: | CCS(N(C)c1ccc2c(c1)cc(C(Nc1ccc(c(c1)[Cl])F)=O)s2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7676 |
| logD: | 4.7087 |
| logSw: | -4.8828 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.063 |
| InChI Key: | TUEXYZRVXPZCKV-UHFFFAOYSA-N |