N-[(Z)-(2-chlorophenyl)methylideneamino]-2H-tetrazol-5-amine
Formula:C8H7N6Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(2-chlorophenyl)methylideneamino]-2H-tetrazol-5-amine is a drug-like molecule.
| MolName | N-[(Z)-(2-chlorophenyl)methylideneamino]-2H-tetrazol-5-amine |
| MolecularFormula | C8H7N6Cl |
| Smiles | Clc1c(/C=N\Nc2n[nH]nn2)cccc1 |
| InChI | InChI=1S/C8H7ClN6/c9-7-4-2-1-3-6(7)5-10-11-8-12-14-15-13-8/h1-5H,(H2,11,12,13,14,15) |
| InChIK | KCNIEMZHJKIPSL-UHFFFAOYSA-N |
| TotalMolweight | 222.639 |
| Molweight | 222.639 |
| MonoisotopicMass | 222.042071 |
| CLogP | 3.4398 |
| CLogS | -3.293 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 170.51 |
| Relative PSA | 0.40977 |
| PolarSurfaceArea | 78.85 |
| Druglikeness | -1.4391 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 15 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Aromatic Nitrogens | 4 |
| StereoCon |
Click to Load Molecule:
1 - N-[(Z)-(2-chlorophenyl)methylideneamino]-2H-tetrazol-5-amine | 2 - N-[(Z)-(2-chlorophenyl)methylideneamino]-2H-tetrazol-5-amine
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off