N'-(4-fluorophenyl)-N-(2-methoxyethyl)-N-{[5-(4-methylpiperazin-1-yl)-3-phenyl-1,2-oxazol-4-yl]methyl}thiourea
Chemical Structure Depiction of
N'-(4-fluorophenyl)-N-(2-methoxyethyl)-N-{[5-(4-methylpiperazin-1-yl)-3-phenyl-1,2-oxazol-4-yl]methyl}thiourea
N'-(4-fluorophenyl)-N-(2-methoxyethyl)-N-{[5-(4-methylpiperazin-1-yl)-3-phenyl-1,2-oxazol-4-yl]methyl}thiourea
Compound characteristics
| Compound ID: | V029-1142 |
| Compound Name: | N'-(4-fluorophenyl)-N-(2-methoxyethyl)-N-{[5-(4-methylpiperazin-1-yl)-3-phenyl-1,2-oxazol-4-yl]methyl}thiourea |
| Molecular Weight: | 483.61 |
| Molecular Formula: | C25 H30 F N5 O2 S |
| Salt: | not_available |
| Smiles: | CN1CCN(CC1)c1c(CN(CCOC)C(Nc2ccc(cc2)F)=S)c(c2ccccc2)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.8767 |
| logD: | 2.4976 |
| logSw: | -4.017 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.795 |
| InChI Key: | XPAWLOKAOOXZBQ-UHFFFAOYSA-N |