5-{[(2H-1,3-benzodioxol-5-yl)amino]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Chemical Structure Depiction of
5-{[(2H-1,3-benzodioxol-5-yl)amino]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
5-{[(2H-1,3-benzodioxol-5-yl)amino]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Compound characteristics
| Compound ID: | D664-0133 |
| Compound Name: | 5-{[(2H-1,3-benzodioxol-5-yl)amino]methyl}-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one |
| Molecular Weight: | 311.34 |
| Molecular Formula: | C17 H17 N3 O3 |
| Smiles: | CN1C(N(C)c2cc(CNc3ccc4c(c3)OCO4)ccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4123 |
| logD: | 2.4119 |
| logSw: | -2.9419 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.273 |
| InChI Key: | WRHMYYJENDATMR-UHFFFAOYSA-N |