N-(5-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(5-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)cyclohexanecarboxamide
N-(5-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | L495-0735 |
| Compound Name: | N-(5-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)cyclohexanecarboxamide |
| Molecular Weight: | 440.59 |
| Molecular Formula: | C22 H24 N4 O2 S2 |
| Smiles: | [H]c1cc2c(cc1NC(Nc1cccc(c1)SC)=O)nc(NC(C1CCCCC1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 6.1901 |
| logD: | 6.1898 |
| logSw: | -5.3032 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.586 |
| InChI Key: | HUXQDODLKAJMHD-UHFFFAOYSA-N |