N-(2-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-methoxybenzamide
Chemical Structure Depiction of
N-(2-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-methoxybenzamide
N-(2-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-methoxybenzamide
Compound characteristics
| Compound ID: | D336-2884 |
| Compound Name: | N-(2-{[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-methoxybenzamide |
| Molecular Weight: | 477.6 |
| Molecular Formula: | C25 H23 N3 O3 S2 |
| Smiles: | Cc1cc(C)cc(c1)NC(CSc1nc2ccc(cc2s1)NC(c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8947 |
| logD: | 5.8946 |
| logSw: | -5.491 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.833 |
| InChI Key: | XQLMEZNDPMKBPE-UHFFFAOYSA-N |