4-chloro-N-(2-{[2-(2,6-diethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-{[2-(2,6-diethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
4-chloro-N-(2-{[2-(2,6-diethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
Compound characteristics
| Compound ID: | 8007-1915 |
| Compound Name: | 4-chloro-N-(2-{[2-(2,6-diethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide |
| Molecular Weight: | 510.08 |
| Molecular Formula: | C26 H24 Cl N3 O2 S2 |
| Smiles: | CCc1cccc(CC)c1NC(CSc1nc2ccc(cc2s1)NC(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.7962 |
| logD: | 6.791 |
| logSw: | -6.4187 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.893 |
| InChI Key: | XCLKCBKXKAYHFS-UHFFFAOYSA-N |