(NE)-N-[(4-chlorophenyl)-morpholin-4-ylmethylidene]benzenesulfonamide
Formula:C17H17N2O3ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-[(4-chlorophenyl)-morpholin-4-ylmethylidene]benzenesulfonamide is a drug-like molecule.
| MolName | (NE)-N-[(4-chlorophenyl)-morpholin-4-ylmethylidene]benzenesulfonamide |
| MolecularFormula | C17H17N2O3ClS |
| Smiles | O=S(c1ccccc1)(/N=C(\c(cc1)ccc1Cl)/N1CCOCC1)=O |
| InChI | InChI=1S/C17H17ClN2O3S/c18-15-8-6-14(7-9-15)17(20-10-12-23-13-11-20)19-24(21,22)16-4-2-1-3-5-16/h1-9H,10-13H2 |
| InChIK | XVBMGXHPNGGCFH-UHFFFAOYSA-N |
| TotalMolweight | 364.852 |
| Molweight | 364.852 |
| MonoisotopicMass | 364.06484 |
| CLogP | 3.1425 |
| CLogS | -3.154 |
| H Acceptors | 5 |
| TotalSurfaceArea | 261.83 |
| Relative PSA | 0.20487 |
| PolarSurfaceArea | 67.35 |
| Druglikeness | -4.1236 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 2 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 7 |
| BasicNitrogens | 1 |
| StereoCon |
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