| MolName | (6Z)-6-benzylidene-4,5-dihydro-2H-cyclopenta[c]pyrazole-3-carbohydrazide |
| MolecularFormula | C14H14N4O |
| Smiles | NNC(c1c(CC/C2=C/c3ccccc3)c2n[nH]1)=O |
| InChI | InChI=1S/C14H14N4O/c15-16-14(19)13-11-7-6-10(12(11)17-18-13)8-9-4-2-1-3-5-9/h1-5,8H,6-7,15H2,(H,16,19)(H,17,18) |
| InChIK | XIEWYWRCNYIOFV-UHFFFAOYSA-N |
| TotalMolweight | 254.292 |
| Molweight | 254.292 |
| MonoisotopicMass | 254.116761 |
| CLogP | 0.296 |
| CLogS | -2.787 |
| H Acceptors | 5 |
| H Donors | 3 |
| TotalSurfaceArea | 197.81 |
| Relative PSA | 0.32723 |
| PolarSurfaceArea | 83.8 |
| Druglikeness | -3.1588 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | hydrazine |
| Shape Index | 0.63158 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 2 |
| StereoCon |
Click to Load Molecule:
1 - (6Z)-6-benzylidene-4,5-dihydro-2H-cyclopenta[c]pyrazole-3-carbohydrazide | 2 - (6Z)-6-benzylidene-4,5-dihydro-2H-cyclopenta[c]pyrazole-3-carbohydrazide