N-(2-{[2-(2-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(2-methylphenoxy)acetamide
Chemical Structure Depiction of
N-(2-{[2-(2-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(2-methylphenoxy)acetamide
N-(2-{[2-(2-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(2-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | D336-1944 |
| Compound Name: | N-(2-{[2-(2-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-(2-methylphenoxy)acetamide |
| Molecular Weight: | 477.6 |
| Molecular Formula: | C25 H23 N3 O3 S2 |
| Smiles: | Cc1ccccc1NC(CSc1nc2ccc(cc2s1)NC(COc1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4434 |
| logD: | 5.4434 |
| logSw: | -5.3288 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.963 |
| InChI Key: | PKULFHQEMDMFOF-UHFFFAOYSA-N |