N-{[1-(2-methylpropyl)-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-(2-methylpropyl)-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-[2-(morpholin-4-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide
N-{[1-(2-methylpropyl)-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-[2-(morpholin-4-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V019-7548 |
| Compound Name: | N-{[1-(2-methylpropyl)-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-[2-(morpholin-4-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 568.69 |
| Molecular Formula: | C29 H36 N4 O6 S |
| Salt: | not_available |
| Smiles: | CC(C)Cn1c(CN(CCN2CCOCC2)C(c2ccc3c(c2)OCO3)=O)cnc1S(Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8495 |
| logD: | 2.8434 |
| logSw: | -3.2517 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.848 |
| InChI Key: | PJXABGBGPGKICQ-UHFFFAOYSA-N |