(NZ)-N-[1-(4-chlorophenyl)-2-[6,7-dichloro-3-[(2E)-2-(4-chlorophenyl)-2-hydroxyiminoethyl]quinoxalin-2-yl]ethylidene]hydroxylamine
Formula:C24H16N4O2Cl4
Mutagenic:low
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[1-(4-chlorophenyl)-2-[6,7-dichloro-3-[(2E)-2-(4-chlorophenyl)-2-hydroxyiminoethyl]quinoxalin-2-yl]ethylidene]hydroxylamine is not a drug-like molecule.
| MolName | (NZ)-N-[1-(4-chlorophenyl)-2-[6,7-dichloro-3-[(2E)-2-(4-chlorophenyl)-2-hydroxyiminoethyl]quinoxalin-2-yl]ethylidene]hydroxylamine |
| MolecularFormula | C24H16N4O2Cl4 |
| Smiles | O/N=C(\Cc1c(C/C(/c(cc2)ccc2Cl)=N/O)nc(cc(c(Cl)c2)Cl)c2n1)/c(cc1)ccc1Cl |
| InChI | InChI=1S/C24H16Cl4N4O2/c25-15-5-1-13(2-6-15)19(31-33)11-23-24(12-20(32-34)14-3-7-16(26)8-4-14)30-22-10-18(28)17(27)9-21(22)29-23/h1-10,33-34H,11-12H2 |
| InChIK | XVSAUVSDAKPRKW-UHFFFAOYSA-N |
| TotalMolweight | 534.229 |
| Molweight | 534.229 |
| MonoisotopicMass | 532.002734 |
| CLogP | 7.4982 |
| CLogS | -8.802 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 372.74 |
| Relative PSA | 0.19091 |
| PolarSurfaceArea | 90.96 |
| Druglikeness | -1.0312 |
| Mutagenic | low |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.47059 |
| Fragments | 1 |
| Non HAtoms | 34 |
| NonCHAtoms | 10 |
| Electronegative Atoms | 10 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - (NZ)-N-[1-(4-chlorophenyl)-2-[6,7-dichloro-3-[(2E)-2-(4-chlorophenyl)-2-hydroxyiminoethyl]quinoxalin-2-yl]ethylidene]hydroxylamine | 2 - (NZ)-N-[1-(4-chlorophenyl)-2-[6,7-dichloro-3-[(2E)-2-(4-chlorophenyl)-2-hydroxyiminoethyl]quinoxalin-2-yl]ethylidene]hydroxylamine
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