N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | D757-0115 |
| Compound Name: | N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-4-[(1-oxo-1,3-dihydro-2H-isoindol-2-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 483.61 |
| Molecular Formula: | C24 H25 N3 O4 S2 |
| Smiles: | CS(c1ccc2c(c1)sc(NC([C@@H]1CC[C@H](CC1)CN1Cc3ccccc3C1=O)=O)n2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5437 |
| logD: | 3.543 |
| logSw: | -3.836 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.678 |
| InChI Key: | GWFGNTRKXRXUBG-UHFFFAOYSA-N |