[(Z)-6,7-dihydro-5H-1-benzofuran-4-ylideneamino] N-(3-chlorophenyl)carbamate
Formula:C15H13N2O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-6,7-dihydro-5H-1-benzofuran-4-ylideneamino] N-(3-chlorophenyl)carbamate is a drug-like molecule.
| MolName | [(Z)-6,7-dihydro-5H-1-benzofuran-4-ylideneamino] N-(3-chlorophenyl)carbamate |
| MolecularFormula | C15H13N2O3Cl |
| Smiles | O=C(Nc1cccc(Cl)c1)O/N=C(/CCC1)\c2c1occ2 |
| InChI | InChI=1S/C15H13ClN2O3/c16-10-3-1-4-11(9-10)17-15(19)21-18-13-5-2-6-14-12(13)7-8-20-14/h1,3-4,7-9H,2,5-6H2,(H,17,19) |
| InChIK | GSTULNGHGHFFKQ-UHFFFAOYSA-N |
| TotalMolweight | 304.732 |
| Molweight | 304.732 |
| MonoisotopicMass | 304.06147 |
| CLogP | 4.3794 |
| CLogS | -5.654 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 228.09 |
| Relative PSA | 0.26358 |
| PolarSurfaceArea | 63.83 |
| Druglikeness | -7.8557 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 4 |
| Amides | 1 |
| StereoCon |
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