N-{[1-(2-methoxyethyl)-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-(prop-2-en-1-yl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{[1-(2-methoxyethyl)-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-(prop-2-en-1-yl)-2H-1,3-benzodioxole-5-carboxamide
N-{[1-(2-methoxyethyl)-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-(prop-2-en-1-yl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V029-8058 |
| Compound Name: | N-{[1-(2-methoxyethyl)-2-(phenylmethanesulfonyl)-1H-imidazol-5-yl]methyl}-N-(prop-2-en-1-yl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 497.57 |
| Molecular Formula: | C25 H27 N3 O6 S |
| Salt: | not_available |
| Smiles: | COCCn1c(CN(CC=C)C(c2ccc3c(c2)OCO3)=O)cnc1S(Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.51 |
| logD: | 2.51 |
| logSw: | -2.8223 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 82.549 |
| InChI Key: | ZNHOPTJVCZMSMQ-UHFFFAOYSA-N |