2-{[(2H-1,3-benzodioxol-5-yl)-N-methylcarbamamido]methyl}-1-ethyl-N,N-dimethyl-1H-benzimidazole-5-carboxamide
Chemical Structure Depiction of
2-{[(2H-1,3-benzodioxol-5-yl)-N-methylcarbamamido]methyl}-1-ethyl-N,N-dimethyl-1H-benzimidazole-5-carboxamide
2-{[(2H-1,3-benzodioxol-5-yl)-N-methylcarbamamido]methyl}-1-ethyl-N,N-dimethyl-1H-benzimidazole-5-carboxamide
Compound characteristics
| Compound ID: | L279-0417 |
| Compound Name: | 2-{[(2H-1,3-benzodioxol-5-yl)-N-methylcarbamamido]methyl}-1-ethyl-N,N-dimethyl-1H-benzimidazole-5-carboxamide |
| Molecular Weight: | 423.47 |
| Molecular Formula: | C22 H25 N5 O4 |
| Smiles: | CCn1c2ccc(cc2nc1CN(C)C(Nc1ccc2c(c1)OCO2)=O)C(N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8006 |
| logD: | 1.8006 |
| logSw: | -2.5526 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.227 |
| InChI Key: | CSSRXOAKOXTPDF-UHFFFAOYSA-N |