N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
Chemical Structure Depiction of
N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
Compound characteristics
| Compound ID: | 8008-4107 |
| Compound Name: | N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide |
| Molecular Weight: | 491.59 |
| Molecular Formula: | C25 H21 N3 O4 S2 |
| Smiles: | CC(c1ccc(cc1)NC(CSc1nc2ccc(cc2s1)NC(c1ccccc1OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5067 |
| logD: | 4.4953 |
| logSw: | -4.4019 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.746 |
| InChI Key: | JRZXMPCUFKFVJA-UHFFFAOYSA-N |