N-cycloheptyl-2-[(Z)-6,7-dihydro-5H-2,1,3-benzoxadiazol-4-ylideneamino]oxyacetamide
Formula:C15H22N4O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-cycloheptyl-2-[(Z)-6,7-dihydro-5H-2,1,3-benzoxadiazol-4-ylideneamino]oxyacetamide is a drug-like molecule.
| MolName | N-cycloheptyl-2-[(Z)-6,7-dihydro-5H-2,1,3-benzoxadiazol-4-ylideneamino]oxyacetamide |
| MolecularFormula | C15H22N4O3 |
| Smiles | O=C(CO/N=C1\c2nonc2CCC1)NC1CCCCCC1 |
| InChI | InChI=1S/C15H22N4O3/c20-14(16-11-6-3-1-2-4-7-11)10-21-17-12-8-5-9-13-15(12)19-22-18-13/h11H,1-10H2,(H,16,20) |
| InChIK | QQGHQJMSXBZZCV-UHFFFAOYSA-N |
| TotalMolweight | 306.365 |
| Molweight | 306.365 |
| MonoisotopicMass | 306.169191 |
| CLogP | 2.691 |
| CLogS | -3.17 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 245.75 |
| Relative PSA | 0.33392 |
| PolarSurfaceArea | 89.61 |
| Druglikeness | -1.1784 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59091 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 5 |
| Sp3Atoms | 12 |
| Symmetricatoms | 3 |
| Amides | 1 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - N-cycloheptyl-2-[(Z)-6,7-dihydro-5H-2,1,3-benzoxadiazol-4-ylideneamino]oxyacetamide | 2 - N-cycloheptyl-2-[(Z)-6,7-dihydro-5H-2,1,3-benzoxadiazol-4-ylideneamino]oxyacetamide
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