(NZ)-4-bromo-N-[morpholin-4-yl(phenyl)methylidene]benzenesulfonamide
Formula:C17H17N2O3BrS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-4-bromo-N-[morpholin-4-yl(phenyl)methylidene]benzenesulfonamide is a drug-like molecule.
| MolName | (NZ)-4-bromo-N-[morpholin-4-yl(phenyl)methylidene]benzenesulfonamide |
| MolecularFormula | C17H17N2O3BrS |
| Smiles | O=S(c(cc1)ccc1Br)(/N=C(/c1ccccc1)\N1CCOCC1)=O |
| InChI | InChI=1S/C17H17BrN2O3S/c18-15-6-8-16(9-7-15)24(21,22)19-17(14-4-2-1-3-5-14)20-10-12-23-13-11-20/h1-9H,10-13H2 |
| InChIK | PJRMJQWJAYKJLC-UHFFFAOYSA-N |
| TotalMolweight | 409.303 |
| Molweight | 409.303 |
| MonoisotopicMass | 408.014324 |
| CLogP | 3.2617 |
| CLogS | -3.252 |
| H Acceptors | 5 |
| TotalSurfaceArea | 265.04 |
| Relative PSA | 0.20238 |
| PolarSurfaceArea | 67.35 |
| Druglikeness | 1.051 |
| 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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