5-amino-1-phenyl-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]pyrazole-4-carboxamide
Formula:C24H21N5O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
5-amino-1-phenyl-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]pyrazole-4-carboxamide is a drug-like molecule.
| MolName | 5-amino-1-phenyl-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]pyrazole-4-carboxamide |
| MolecularFormula | C24H21N5O2 |
| Smiles | Nc(n(-c1ccccc1)nc1)c1C(N/N=C\c(cc1)ccc1OCc1ccccc1)=O |
| InChI | InChI=1S/C24H21N5O2/c25-23-22(16-27-29(23)20-9-5-2-6-10-20)24(30)28-26-15-18-11-13-21(14-12-18)31-17-19-7-3-1-4-8-19/h1-16H,17,25H2,(H,28,30) |
| InChIK | JZBBZLDHYGQANB-UHFFFAOYSA-N |
| TotalMolweight | 411.464 |
| Molweight | 411.464 |
| MonoisotopicMass | 411.169525 |
| CLogP | 3.3926 |
| CLogS | -5.398 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 326.75 |
| Relative PSA | 0.24214 |
| PolarSurfaceArea | 94.53 |
| Druglikeness | 6.1846 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.67742 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 3 |
| Symmetricatoms | 6 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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