N-[(Z)-(3-bromothiophen-2-yl)methylideneamino]-2-hydroxy-2,2-diphenylacetamide
Formula:C19H15N2O2BrS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(3-bromothiophen-2-yl)methylideneamino]-2-hydroxy-2,2-diphenylacetamide is a drug-like molecule.
| MolName | N-[(Z)-(3-bromothiophen-2-yl)methylideneamino]-2-hydroxy-2,2-diphenylacetamide |
| MolecularFormula | C19H15N2O2BrS |
| Smiles | OC(C(N/N=C\c(scc1)c1Br)=O)(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C19H15BrN2O2S/c20-16-11-12-25-17(16)13-21-22-18(23)19(24,14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,24H,(H,22,23) |
| InChIK | BANSROCUBMDKJG-UHFFFAOYSA-N |
| TotalMolweight | 415.31 |
| Molweight | 415.31 |
| MonoisotopicMass | 414.003759 |
| CLogP | 4.0737 |
| CLogS | -5.271 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 278.08 |
| Relative PSA | 0.24982 |
| PolarSurfaceArea | 89.93 |
| Druglikeness | 1.0085 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.48 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 2 |
| Symmetricatoms | 8 |
| StereoCon |
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