N-(5-{[(3-methoxyphenyl)methyl]carbamamido}-1,3-benzothiazol-2-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(5-{[(3-methoxyphenyl)methyl]carbamamido}-1,3-benzothiazol-2-yl)cyclohexanecarboxamide
N-(5-{[(3-methoxyphenyl)methyl]carbamamido}-1,3-benzothiazol-2-yl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | L495-0729 |
| Compound Name: | N-(5-{[(3-methoxyphenyl)methyl]carbamamido}-1,3-benzothiazol-2-yl)cyclohexanecarboxamide |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Smiles: | [H]c1cc2c(cc1NC(NCc1cccc(c1)OC)=O)nc(NC(C1CCCCC1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.043 |
| logD: | 5.0427 |
| logSw: | -4.7015 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.452 |
| InChI Key: | BOUYUSQNYKWTQV-UHFFFAOYSA-N |