N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)-2H-1,3-benzodioxole-5-carboxamide
N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V024-3189 |
| Compound Name: | N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-N-(prop-2-en-1-yl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 535.66 |
| Molecular Formula: | C29 H33 N3 O5 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(CS(c2ncc(CN(CC=C)C(c3ccc4c(c3)OCO4)=O)n2C2CCCCC2)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.1172 |
| logD: | 5.1172 |
| logSw: | -4.8066 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.533 |
| InChI Key: | AHMLQWRDWWEFOB-UHFFFAOYSA-N |