N-{5-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}cyclohexanecarboxamide
Chemical Structure Depiction of
N-{5-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}cyclohexanecarboxamide
N-{5-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}cyclohexanecarboxamide
Compound characteristics
| Compound ID: | L495-0731 |
| Compound Name: | N-{5-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}cyclohexanecarboxamide |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | [H]c1cc2c(cc1NC(Nc1ccc3c(c1)OCO3)=O)nc(NC(C1CCCCC1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.5623 |
| logD: | 5.5619 |
| logSw: | -5.671 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.702 |
| InChI Key: | WPADWAGKQRZHKR-UHFFFAOYSA-N |