N-(2-{[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methylbenzamide
Chemical Structure Depiction of
N-(2-{[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methylbenzamide
N-(2-{[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methylbenzamide
Compound characteristics
| Compound ID: | 8008-5827 |
| Compound Name: | N-(2-{[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methylbenzamide |
| Molecular Weight: | 482.02 |
| Molecular Formula: | C24 H20 Cl N3 O2 S2 |
| Smiles: | Cc1ccccc1C(Nc1ccc2c(c1)sc(n2)SCC(Nc1cc(ccc1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8157 |
| logD: | 5.8136 |
| logSw: | -5.8507 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.591 |
| InChI Key: | CDJOORRDEFPAFT-UHFFFAOYSA-N |