(NZ)-4-bromo-N-[(4-chlorophenyl)-morpholin-4-ylmethylidene]benzenesulfonamide
Molecular Formula : C17H16N2O3BrClS | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |(NZ)-4-bromo-N-[(4-chlorophenyl)-morpholin-4-ylmethylidene]benzenesulfonamide is a drug-like molecule.
MolName : (NZ)-4-bromo-N-[(4-chlorophenyl)-morpholin-4-ylmethylidene]benzenesulfonamide |
MolecularFormula : C17H16N2O3BrClS |
Smiles : O=S(c(cc1)ccc1Br)(/N=C(/c(cc1)ccc1Cl)\N1CCOCC1)=O |
InChI : InChI=1S/C17H16BrClN2O3S/c18-14-3-7-16(8-4-14)25(22,23)20-17(21-9-11-24-12-10-21)13-1-5-15(19)6-2-13/h1-8H,9-12H2 |
InChIK : HUEGNBGEHHTYKH-UHFFFAOYSA-N |
TotalMolweight : 443.748 |
Molweight : 443.748 |
MonoisotopicMass : 441.975351 |
CLogP : 3.8677 |
CLogS : -3.988 |
H Acceptors : 5 |
TotalSurfaceArea : 280.46 |
Relative PSA : 0.19126 |
PolarSurfaceArea : 67.35 |
Druglikeness : 1.457 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.52 |
Fragments : 1 |
Non HAtoms : 25 |
NonCHAtoms : 8 |
Electronegative Atoms : 8 |
Rotatable Bond : 2 |
Rings Closures : 3 |
Small Rings : 3 |
Aromatic Rings : 2 |
Aromatic Atoms : 12 |
Sp3Atoms : 6 |
Symmetricatoms : 7 |
BasicNitrogens : 1 |
StereoCon : |