[(Z)-phenacylideneamino] N-(4-chlorophenyl)carbamate
Formula:C15H11N2O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-phenacylideneamino] N-(4-chlorophenyl)carbamate is a drug-like molecule.
| MolName | [(Z)-phenacylideneamino] N-(4-chlorophenyl)carbamate |
| MolecularFormula | C15H11N2O3Cl |
| Smiles | O=C(/C=N\OC(Nc(cc1)ccc1Cl)=O)c1ccccc1 |
| InChI | InChI=1S/C15H11ClN2O3/c16-12-6-8-13(9-7-12)18-15(20)21-17-10-14(19)11-4-2-1-3-5-11/h1-10H,(H,18,20) |
| InChIK | FQMMSVAPMJIIDF-UHFFFAOYSA-N |
| TotalMolweight | 302.716 |
| Molweight | 302.716 |
| MonoisotopicMass | 302.04582 |
| CLogP | 3.3169 |
| CLogS | -5.091 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 230.16 |
| Relative PSA | 0.25656 |
| PolarSurfaceArea | 67.76 |
| Druglikeness | -5.6732 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - [(Z)-phenacylideneamino] N-(4-chlorophenyl)carbamate | 2 - [(Z)-phenacylideneamino] N-(4-chlorophenyl)carbamate
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off