N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]benzenesulfonamide
Formula:C21H18N2O3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]benzenesulfonamide is a drug-like molecule.
| MolName | N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]benzenesulfonamide |
| MolecularFormula | C21H18N2O3S |
| Smiles | O=S(c1ccccc1)(N/N=C(\C1)/c(cccc2)c2OC1c1ccccc1)=O |
| InChI | InChI=1S/C21H18N2O3S/c24-27(25,17-11-5-2-6-12-17)23-22-19-15-21(16-9-3-1-4-10-16)26-20-14-8-7-13-18(19)20/h1-14,21,23H,15H2/t21-/m1/s1 |
| InChIK | VBUXUIBABREPPX-OAQYLSRUSA-N |
| TotalMolweight | 378.451 |
| Molweight | 378.451 |
| MonoisotopicMass | 378.103813 |
| CLogP | 3.877 |
| CLogS | -3.504 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 278.55 |
| Relative PSA | 0.22097 |
| PolarSurfaceArea | 76.14 |
| Druglikeness | -3.0213 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.51852 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| StereoCenters | 1 |
| Rotatable Bond | 3 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 5 |
| StereoCon | racemate |
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1 - N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]benzenesulfonamide | 2 - N-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]benzenesulfonamide
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