N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-hydroxybenzamide
Formula:C21H17N2O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-hydroxybenzamide is a drug-like molecule.
| MolName | N-[(Z)-[2-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-2-hydroxybenzamide |
| MolecularFormula | C21H17N2O3Cl |
| Smiles | Oc(cccc1)c1C(N/N=C\c(cccc1)c1OCc(cc1)ccc1Cl)=O |
| InChI | InChI=1S/C21H17ClN2O3/c22-17-11-9-15(10-12-17)14-27-20-8-4-1-5-16(20)13-23-24-21(26)18-6-2-3-7-19(18)25/h1-13,25H,14H2,(H,24,26) |
| InChIK | AOXUNZIYBCPENY-UHFFFAOYSA-N |
| TotalMolweight | 380.83 |
| Molweight | 380.83 |
| MonoisotopicMass | 380.09277 |
| CLogP | 4.81 |
| CLogS | -5.502 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 292.28 |
| Relative PSA | 0.20224 |
| PolarSurfaceArea | 70.92 |
| Druglikeness | 4.0392 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.62963 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| StereoCon |
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