5-[(4-chlorobenzene-1-sulfonyl)(methyl)amino]-N-[(pyridin-3-yl)methyl]-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
5-[(4-chlorobenzene-1-sulfonyl)(methyl)amino]-N-[(pyridin-3-yl)methyl]-1-benzothiophene-2-carboxamide
5-[(4-chlorobenzene-1-sulfonyl)(methyl)amino]-N-[(pyridin-3-yl)methyl]-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | J019-0478 |
| Compound Name: | 5-[(4-chlorobenzene-1-sulfonyl)(methyl)amino]-N-[(pyridin-3-yl)methyl]-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 471.98 |
| Molecular Formula: | C22 H18 Cl N3 O3 S2 |
| Smiles: | CN(c1ccc2c(c1)cc(C(NCc1cccnc1)=O)s2)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3998 |
| logD: | 4.3997 |
| logSw: | -4.5335 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.738 |
| InChI Key: | MOGCUBDFCOCNQW-UHFFFAOYSA-N |