N-{[1-benzyl-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-[2-(morpholin-4-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{[1-benzyl-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-[2-(morpholin-4-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide
N-{[1-benzyl-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-[2-(morpholin-4-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V027-5267 |
| Compound Name: | N-{[1-benzyl-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-[2-(morpholin-4-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 602.71 |
| Molecular Formula: | C32 H34 N4 O6 S |
| Salt: | not_available |
| Smiles: | C(CN(Cc1cnc(n1Cc1ccccc1)S(Cc1ccccc1)(=O)=O)C(c1ccc2c(c1)OCO2)=O)N1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.1207 |
| logD: | 3.1147 |
| logSw: | -3.2789 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.576 |
| InChI Key: | FXMHWWUKDBVDRN-UHFFFAOYSA-N |