N-[2-[[(Z)-(2-chlorophenyl)methylideneamino]carbamoyl]phenyl]thiophene-2-carboxamide
Formula:C19H14N3O2ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[2-[[(Z)-(2-chlorophenyl)methylideneamino]carbamoyl]phenyl]thiophene-2-carboxamide is a drug-like molecule.
| MolName | N-[2-[[(Z)-(2-chlorophenyl)methylideneamino]carbamoyl]phenyl]thiophene-2-carboxamide |
| MolecularFormula | C19H14N3O2ClS |
| Smiles | O=C(c1cccs1)Nc(cccc1)c1C(N/N=C\c(cccc1)c1Cl)=O |
| InChI | InChI=1S/C19H14ClN3O2S/c20-15-8-3-1-6-13(15)12-21-23-18(24)14-7-2-4-9-16(14)22-19(25)17-10-5-11-26-17/h1-12H,(H,22,25)(H,23,24) |
| InChIK | ADLLETYSMAVVOH-UHFFFAOYSA-N |
| TotalMolweight | 383.858 |
| Molweight | 383.858 |
| MonoisotopicMass | 383.049524 |
| CLogP | 4.8217 |
| CLogS | -5.979 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 287.32 |
| Relative PSA | 0.28146 |
| PolarSurfaceArea | 98.8 |
| Druglikeness | 6.6196 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.57692 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Amides | 1 |
| StereoCon |
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