N-{3-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{3-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
N-{3-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | F779-1079 |
| Compound Name: | N-{3-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C24 H21 N3 O3 |
| Smiles: | Cn1c2ccccc2nc1CCc1cccc(c1)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5167 |
| logD: | 4.3919 |
| logSw: | -4.4426 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.16 |
| InChI Key: | MKIAOTLSZCKSBE-UHFFFAOYSA-N |