N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2H-1,3-benzodioxole-5-carboxamide
N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | 8188-1197 |
| Compound Name: | N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C22 H16 N2 O3 S |
| Smiles: | Cc1c(cccc1NC(c1ccc2c(c1)OCO2)=O)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 5.2804 |
| logD: | 5.2804 |
| logSw: | -5.1538 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.196 |
| InChI Key: | VCBZVDHRGGGNJV-UHFFFAOYSA-N |