(NZ)-N-[(4-benzhydrylpiperazin-1-yl)-phenylmethylidene]benzenesulfonamide
Formula:C30H29N3O2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(4-benzhydrylpiperazin-1-yl)-phenylmethylidene]benzenesulfonamide is not a drug-like molecule.
| MolName | (NZ)-N-[(4-benzhydrylpiperazin-1-yl)-phenylmethylidene]benzenesulfonamide |
| MolecularFormula | C30H29N3O2S |
| Smiles | O=S(c1ccccc1)(/N=C(/c1ccccc1)\N(CC1)CCN1C(c1ccccc1)c1ccccc1)=O |
| InChI | InChI=1S/C30H29N3O2S/c34-36(35,28-19-11-4-12-20-28)31-30(27-17-9-3-10-18-27)33-23-21-32(22-24-33)29(25-13-5-1-6-14-25)26-15-7-2-8-16-26/h1-20,29H,21-24H2 |
| InChIK | ARRTXHINCFKBQM-UHFFFAOYSA-N |
| TotalMolweight | 495.645 |
| Molweight | 495.645 |
| MonoisotopicMass | 495.198047 |
| CLogP | 5.7798 |
| CLogS | -4.503 |
| H Acceptors | 5 |
| TotalSurfaceArea | 378.73 |
| Relative PSA | 0.1246 |
| PolarSurfaceArea | 61.36 |
| Druglikeness | 0.076192 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.44444 |
| Fragments | 1 |
| Non HAtoms | 36 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 7 |
| Symmetricatoms | 15 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 2 |
| StereoCon |
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