[(E)-[amino(1,2-oxazol-5-yl)methylidene]amino] N-(3-chlorophenyl)carbamate
Formula:C11H9N4O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
[(E)-[amino(1,2-oxazol-5-yl)methylidene]amino] N-(3-chlorophenyl)carbamate is a drug-like molecule.
| MolName | [(E)-[amino(1,2-oxazol-5-yl)methylidene]amino] N-(3-chlorophenyl)carbamate |
| MolecularFormula | C11H9N4O3Cl |
| Smiles | N/C(/c1ccno1)=N/OC(Nc1cccc(Cl)c1)=O |
| InChI | InChI=1S/C11H9ClN4O3/c12-7-2-1-3-8(6-7)15-11(17)19-16-10(13)9-4-5-14-18-9/h1-6H,(H2,13,16)(H,15,17) |
| InChIK | WXRULVRFRCOVPH-UHFFFAOYSA-N |
| TotalMolweight | 280.67 |
| Molweight | 280.67 |
| MonoisotopicMass | 280.036318 |
| CLogP | 2.1363 |
| CLogS | -3.909 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 207.59 |
| Relative PSA | 0.41601 |
| PolarSurfaceArea | 102.74 |
| Druglikeness | -4.8168 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.63158 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 1 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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