N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide
Formula:C23H19N6O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide is a drug-like molecule.
| MolName | N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide |
| MolecularFormula | C23H19N6O3Cl |
| Smiles | O=C(COc(cc1)ccc1-n1nnnc1)N/N=C\c(cccc1)c1OCc(cc1)ccc1Cl |
| InChI | InChI=1S/C23H19ClN6O3/c24-19-7-5-17(6-8-19)14-33-22-4-2-1-3-18(22)13-25-27-23(31)15-32-21-11-9-20(10-12-21)30-16-26-28-29-30/h1-13,16H,14-15H2,(H,27,31) |
| InChIK | INKNPPNVMXOSET-UHFFFAOYSA-N |
| TotalMolweight | 462.896 |
| Molweight | 462.896 |
| MonoisotopicMass | 462.120716 |
| CLogP | 3.6292 |
| CLogS | -5.877 |
| H Acceptors | 9 |
| H Donors | 1 |
| TotalSurfaceArea | 354.93 |
| Relative PSA | 0.26988 |
| PolarSurfaceArea | 103.52 |
| Druglikeness | 3.1521 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 33 |
| NonCHAtoms | 10 |
| Electronegative Atoms | 10 |
| Rotatable Bond | 9 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 4 |
| StereoCon |
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1 - N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide | 2 - N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-[4-(tetrazol-1-yl)phenoxy]acetamide
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