N-(2-{[2-(4-butoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
Chemical Structure Depiction of
N-(2-{[2-(4-butoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
N-(2-{[2-(4-butoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide
Compound characteristics
| Compound ID: | 8008-5808 |
| Compound Name: | N-(2-{[2-(4-butoxyanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)-2-methoxybenzamide |
| Molecular Weight: | 521.66 |
| Molecular Formula: | C27 H27 N3 O4 S2 |
| Smiles: | CCCCOc1ccc(cc1)NC(CSc1nc2ccc(cc2s1)NC(c1ccccc1OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3969 |
| logD: | 6.3855 |
| logSw: | -5.608 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.337 |
| InChI Key: | JBQRJQNZJSWZCZ-UHFFFAOYSA-N |