N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-phenylpropanamide
Chemical Structure Depiction of
N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-phenylpropanamide
N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-phenylpropanamide
Compound characteristics
| Compound ID: | 8007-8670 |
| Compound Name: | N-(2-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-3-phenylpropanamide |
| Molecular Weight: | 489.61 |
| Molecular Formula: | C26 H23 N3 O3 S2 |
| Smiles: | CC(c1ccc(cc1)NC(CSc1nc2ccc(cc2s1)NC(CCc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0577 |
| logD: | 5.0575 |
| logSw: | -4.6902 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.902 |
| InChI Key: | BSMHTNDUUBYMLV-UHFFFAOYSA-N |