(2E)-1,3-diphenyl-5-phenylimino-2-pyridin-2-yliminoimidazolidine-4-thione
Formula:C26H19N5S
Mutagenic:low
Tumorigenic:low
Reproductive Effective:none
(2E)-1,3-diphenyl-5-phenylimino-2-pyridin-2-yliminoimidazolidine-4-thione is a drug-like molecule.
| MolName | (2E)-1,3-diphenyl-5-phenylimino-2-pyridin-2-yliminoimidazolidine-4-thione |
| MolecularFormula | C26H19N5S |
| Smiles | S=C(/C(/N(/C1=N\c2ncccc2)c2ccccc2)=N\c2ccccc2)N1c1ccccc1 |
| InChI | InChI=1S/C26H19N5S/c32-25-24(28-20-12-4-1-5-13-20)30(21-14-6-2-7-15-21)26(29-23-18-10-11-19-27-23)31(25)22-16-8-3-9-17-22/h1-19H |
| InChIK | NTFQVQVCZMCMMY-UHFFFAOYSA-N |
| TotalMolweight | 433.538 |
| Molweight | 433.538 |
| MonoisotopicMass | 433.136115 |
| CLogP | 4.2652 |
| CLogS | -6.809 |
| H Acceptors | 5 |
| TotalSurfaceArea | 337.05 |
| Relative PSA | 0.20498 |
| PolarSurfaceArea | 76.18 |
| Druglikeness | 1.0427 |
| Mutagenic | low |
| Tumorigenic | low |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | thio-amide/urea |
| Shape Index | 0.40625 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 1 |
| Symmetricatoms | 6 |
| Aromatic Nitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - (2E)-1,3-diphenyl-5-phenylimino-2-pyridin-2-yliminoimidazolidine-4-thione | 2 - (2E)-1,3-diphenyl-5-phenylimino-2-pyridin-2-yliminoimidazolidine-4-thione
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off