N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-N-[2-(dimethylamino)ethyl]-N'-(4-fluorophenyl)thiourea
Chemical Structure Depiction of
N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-N-[2-(dimethylamino)ethyl]-N'-(4-fluorophenyl)thiourea
N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-N-[2-(dimethylamino)ethyl]-N'-(4-fluorophenyl)thiourea
Compound characteristics
| Compound ID: | V021-0401 |
| Compound Name: | N-({1-cyclohexyl-2-[(3-methylphenyl)methanesulfonyl]-1H-imidazol-5-yl}methyl)-N-[2-(dimethylamino)ethyl]-N'-(4-fluorophenyl)thiourea |
| Molecular Weight: | 571.78 |
| Molecular Formula: | C29 H38 F N5 O2 S2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(CS(c2ncc(CN(CCN(C)C)C(Nc3ccc(cc3)F)=S)n2C2CCCCC2)(=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.7236 |
| logD: | 3.0425 |
| logSw: | -5.2315 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.533 |
| InChI Key: | BFCJTSNDIPXEQY-UHFFFAOYSA-N |