N-{4-[2-(1-carbamothioyl-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazinyl]phenyl}acetamide
Chemical Structure Depiction of
N-{4-[2-(1-carbamothioyl-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazinyl]phenyl}acetamide
N-{4-[2-(1-carbamothioyl-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazinyl]phenyl}acetamide
Compound characteristics
| Compound ID: | 1697-1482 |
| Compound Name: | N-{4-[2-(1-carbamothioyl-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene)hydrazinyl]phenyl}acetamide |
| Molecular Weight: | 318.35 |
| Molecular Formula: | C13 H14 N6 O2 S |
| Smiles: | CC1\C(C(N(C(N)=S)N=1)=O)=N/Nc1ccc(cc1)NC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6799 |
| logD: | 0.6781 |
| logSw: | -1.8991 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 85.604 |
| InChI Key: | XNKWTAXPOFCJRM-GZTJUZNOSA-N |