[(Z)-(2-phenylchromen-4-ylidene)amino] N-(4-chlorophenyl)carbamate
Formula:C22H15N2O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(Z)-(2-phenylchromen-4-ylidene)amino] N-(4-chlorophenyl)carbamate is not a drug-like molecule.
| MolName | [(Z)-(2-phenylchromen-4-ylidene)amino] N-(4-chlorophenyl)carbamate |
| MolecularFormula | C22H15N2O3Cl |
| Smiles | O=C(Nc(cc1)ccc1Cl)O/N=C1\c(cccc2)c2OC(c2ccccc2)=C1 |
| InChI | InChI=1S/C22H15ClN2O3/c23-16-10-12-17(13-11-16)24-22(26)28-25-19-14-21(15-6-2-1-3-7-15)27-20-9-5-4-8-18(19)20/h1-14H,(H,24,26) |
| InChIK | BUHCRSSUHVVFJI-UHFFFAOYSA-N |
| TotalMolweight | 390.825 |
| Molweight | 390.825 |
| MonoisotopicMass | 390.07712 |
| CLogP | 6.2979 |
| CLogS | -6.827 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 291.59 |
| Relative PSA | 0.19208 |
| PolarSurfaceArea | 59.92 |
| Druglikeness | -5.0032 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - [(Z)-(2-phenylchromen-4-ylidene)amino] N-(4-chlorophenyl)carbamate | 2 - [(Z)-(2-phenylchromen-4-ylidene)amino] N-(4-chlorophenyl)carbamate
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