[(Z)-2,3-dihydroinden-1-ylideneamino] N-(4-chlorophenyl)carbamate
Formula:C16H13N2O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-2,3-dihydroinden-1-ylideneamino] N-(4-chlorophenyl)carbamate is a drug-like molecule.
| MolName | [(Z)-2,3-dihydroinden-1-ylideneamino] N-(4-chlorophenyl)carbamate |
| MolecularFormula | C16H13N2O2Cl |
| Smiles | O=C(Nc(cc1)ccc1Cl)O/N=C(/CC1)\c2c1cccc2 |
| InChI | InChI=1S/C16H13ClN2O2/c17-12-6-8-13(9-7-12)18-16(20)21-19-15-10-5-11-3-1-2-4-14(11)15/h1-4,6-9H,5,10H2,(H,18,20) |
| InChIK | FPZFZMDBMYZTKK-UHFFFAOYSA-N |
| TotalMolweight | 300.744 |
| Molweight | 300.744 |
| MonoisotopicMass | 300.066555 |
| CLogP | 4.8487 |
| CLogS | -5.702 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 224.64 |
| Relative PSA | 0.20482 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | -6.3449 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - [(Z)-2,3-dihydroinden-1-ylideneamino] N-(4-chlorophenyl)carbamate | 2 - [(Z)-2,3-dihydroinden-1-ylideneamino] N-(4-chlorophenyl)carbamate
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