MolName : (NZ)-N-[morpholin-4-yl(phenyl)methylidene]thiophene-2-sulfonamide |
MolecularFormula : C15H16N2O3S2 |
Smiles : O=S(c1cccs1)(/N=C(/c1ccccc1)\N1CCOCC1)=O |
InChI : InChI=1S/C15H16N2O3S2/c18-22(19,14-7-4-12-21-14)16-15(13-5-2-1-3-6-13)17-8-10-20-11-9-17/h1-7,12H,8-11H2 |
InChIK : LXCQOWMXWYETJC-UHFFFAOYSA-N |
TotalMolweight : 336.435 |
Molweight : 336.435 |
MonoisotopicMass : 336.060233 |
CLogP : 2.5256 |
CLogS : -2.335 |
H Acceptors : 5 |
TotalSurfaceArea : 242.35 |
Relative PSA : 0.30534 |
PolarSurfaceArea : 95.59 |
Druglikeness : 2.9862 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.45455 |
Fragments : 1 |
Non HAtoms : 22 |
NonCHAtoms : 7 |
Electronegative Atoms : 7 |
Rotatable Bond : 2 |
Rings Closures : 3 |
Small Rings : 3 |
Aromatic Rings : 2 |
Aromatic Atoms : 11 |
Sp3Atoms : 6 |
Symmetricatoms : 5 |
BasicNitrogens : 1 |
StereoCon : |