2-(1H-benzimidazol-2-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of
2-(1H-benzimidazol-2-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carboxamide
2-(1H-benzimidazol-2-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | Y044-5599 |
| Compound Name: | 2-(1H-benzimidazol-2-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carboxamide |
| Molecular Weight: | 378.43 |
| Molecular Formula: | C21 H22 N4 O3 |
| Smiles: | C1CC(c2nc3ccccc3[nH]2)N(C1)C(Nc1ccc2c(c1)OCCCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3883 |
| logD: | 2.3883 |
| logSw: | -2.995 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.941 |
| InChI Key: | SMOGRGLSJVNTKW-KRWDZBQOSA-N |