5-(Methanesulfonyl)-4-phenyl-1,3-thiazol-2-amine

Formula:C10H10N2O2S2 CAS:1000018-51-8 ChemrytIQ

PropertyValue
Casrn1000018-51-8
MolName5-(Methanesulfonyl)-4-phenyl-1,3-thiazol-2-amine
MolecularFormulaC10H10N2O2S2
SmilesCS(c1c(-c2ccccc2)nc(N)s1)(=O)=O
InChIInChI=1S/C10H10N2O2S2/c1-16(13,14)9-8(12-10(11)15-9)7-5-3-2-4-6-7/h2-6H,1H3,(H2,11,12)
InChIKMENYNNGOWMJUEG-UHFFFAOYSA-N
CanonicalSyTyLFy443d515a8f90b24d
TotalMolweight254.333
Molweight254.333
MonoisotopicMass254.018368
CLogP1.5645
CLogS-3.637
H Acceptors4
H Donors1
TotalSurfaceArea177.08
Relative PSA0.42455
PolarSurfaceArea109.67
Druglikeness1.3137
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5
Molecula Flexibility0.46955
Molecular Complexity0.75329
Fragments1
Non HAtoms16
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond2
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms11
Sp3Atoms2
Symmetricatoms3
Aromatic Nitrogens1
StereoCon
CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness ChemrytIQ
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