2,4-dichloro-N-(2-{[(2-methoxy-5-nitrophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Chemical Structure Depiction of
2,4-dichloro-N-(2-{[(2-methoxy-5-nitrophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
2,4-dichloro-N-(2-{[(2-methoxy-5-nitrophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Compound characteristics
| Compound ID: | 8009-7618 |
| Compound Name: | 2,4-dichloro-N-(2-{[(2-methoxy-5-nitrophenyl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide |
| Molecular Weight: | 520.41 |
| Molecular Formula: | C22 H15 Cl2 N3 O4 S2 |
| Smiles: | COc1ccc(cc1CSc1nc2ccc(cc2s1)NC(c1ccc(cc1[Cl])[Cl])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 6.8446 |
| logD: | 6.8012 |
| logSw: | -6.4114 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.151 |
| InChI Key: | AMGCEZGMJXYYSL-UHFFFAOYSA-N |