N-({2-[(3-chlorophenyl)methanesulfonyl]-1-(propan-2-yl)-1H-imidazol-5-yl}methyl)-N'-(4-fluorophenyl)-N-[(oxolan-2-yl)methyl]thiourea
Chemical Structure Depiction of
N-({2-[(3-chlorophenyl)methanesulfonyl]-1-(propan-2-yl)-1H-imidazol-5-yl}methyl)-N'-(4-fluorophenyl)-N-[(oxolan-2-yl)methyl]thiourea
N-({2-[(3-chlorophenyl)methanesulfonyl]-1-(propan-2-yl)-1H-imidazol-5-yl}methyl)-N'-(4-fluorophenyl)-N-[(oxolan-2-yl)methyl]thiourea
Compound characteristics
| Compound ID: | V028-2865 |
| Compound Name: | N-({2-[(3-chlorophenyl)methanesulfonyl]-1-(propan-2-yl)-1H-imidazol-5-yl}methyl)-N'-(4-fluorophenyl)-N-[(oxolan-2-yl)methyl]thiourea |
| Molecular Weight: | 565.13 |
| Molecular Formula: | C26 H30 Cl F N4 O3 S2 |
| Salt: | not_available |
| Smiles: | CC(C)n1c(CN(CC2CCCO2)C(Nc2ccc(cc2)F)=S)cnc1S(Cc1cccc(c1)[Cl])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8976 |
| logD: | 4.8976 |
| logSw: | -4.8406 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.842 |
| InChI Key: | BJALAVPTQZTZRV-XMMPIXPASA-N |