N-[(Z)-1-chloro-2-dichlorophosphanylethenyl]-N-phenylaniline
Formula:C14H11NCl3P
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-1-chloro-2-dichlorophosphanylethenyl]-N-phenylaniline is a drug-like molecule.
| MolName | N-[(Z)-1-chloro-2-dichlorophosphanylethenyl]-N-phenylaniline |
| MolecularFormula | C14H11NCl3P |
| Smiles | Cl/C(/N(c1ccccc1)c1ccccc1)=C\P(Cl)Cl |
| InChI | InChI=1S/C14H11Cl3NP/c15-14(11-19(16)17)18(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-11H |
| InChIK | XGMGHXVAUPKXTQ-UHFFFAOYSA-N |
| TotalMolweight | 330.581 |
| Molweight | 330.581 |
| MonoisotopicMass | 328.969467 |
| CLogP | 3.0484 |
| CLogS | -6.607 |
| H Acceptors | 1 |
| TotalSurfaceArea | 221.04 |
| Relative PSA | 0.01606 |
| PolarSurfaceArea | 16.83 |
| Druglikeness | -11.008 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | Cl,Br,I on N,O,P,S,Se,I |
| Shape Index | 0.47368 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 9 |
| StereoCon |
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