N-(3-cyanophenyl)-N'-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiourea
Chemical Structure Depiction of
N-(3-cyanophenyl)-N'-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiourea
N-(3-cyanophenyl)-N'-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiourea
Compound characteristics
| Compound ID: | 8015-0327 |
| Compound Name: | N-(3-cyanophenyl)-N'-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)thiourea |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C19 H17 N5 O S |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(Nc1cccc(C#N)c1)=S |
| Stereo: | ACHIRAL |
| logP: | 2.3022 |
| logD: | 2.3002 |
| logSw: | -2.9829 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 56.498 |
| InChI Key: | YITLWOUAXFFWPY-UHFFFAOYSA-N |