| MolName | [(Z)-2-[(2-phenylacetyl)amino]ethylideneamino] N-(3,4-dichlorophenyl)carbamate |
| MolecularFormula | C17H15N3O3Cl2 |
| Smiles | O=C(Cc1ccccc1)NC/C=N\OC(Nc(cc1)cc(Cl)c1Cl)=O |
| InChI | InChI=1S/C17H15Cl2N3O3/c18-14-7-6-13(11-15(14)19)22-17(24)25-21-9-8-20-16(23)10-12-4-2-1-3-5-12/h1-7,9,11H,8,10H2,(H,20,23)(H,22,24) |
| InChIK | GBQHRVWDEJNVIG-UHFFFAOYSA-N |
| TotalMolweight | 380.23 |
| Molweight | 380.23 |
| MonoisotopicMass | 379.049046 |
| CLogP | 3.8949 |
| CLogS | -5.413 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 284.56 |
| Relative PSA | 0.24779 |
| PolarSurfaceArea | 79.79 |
| Druglikeness | -4.561 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.72 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 7 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| Amides | 2 |
| StereoCon |
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1 - [(Z)-2-[(2-phenylacetyl)amino]ethylideneamino] N-(3,4-dichlorophenyl)carbamate | 2 - [(Z)-2-[(2-phenylacetyl)amino]ethylideneamino] N-(3,4-dichlorophenyl)carbamate