2-(2,4-difluorophenyl)-3-thiophen-2-yl-5-[(E)-2-thiophen-2-ylethenyl]-3,4-dihydropyrazole

Formula:C19H14N2F2S2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(2,4-difluorophenyl)-3-thiophen-2-yl-5-[(E)-2-thiophen-2-ylethenyl]-3,4-dihydropyrazole is not a drug-like molecule.

MolName2-(2,4-difluorophenyl)-3-thiophen-2-yl-5-[(E)-2-thiophen-2-ylethenyl]-3,4-dihydropyrazole
MolecularFormulaC19H14N2F2S2
SmilesFc(cc1)cc(F)c1N(C(C1)c2cccs2)N=C1/C=C/c1cccs1
InChIInChI=1S/C19H14F2N2S2/c20-13-5-8-17(16(21)11-13)23-18(19-4-2-10-25-19)12-14(22-23)6-7-15-3-1-9-24-15/h1-11,18H,12H2/t18-/m1/s1
InChIKDDEGZWICJZXZQI-GOSISDBHSA-N
TotalMolweight372.462
Molweight372.462
MonoisotopicMass372.056644
CLogP5.6068
CLogS-5.343
H Acceptors2
TotalSurfaceArea269.89
Relative PSA0.20668
PolarSurfaceArea72.08
Druglikeness3.2555
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.52
Fragments1
Non HAtoms25
NonCHAtoms6
Electronegative Atoms6
StereoCenters1
Rotatable Bond4
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms16
Sp3Atoms3
StereoConracemate

Request More Details | 2-(2,4-difluorophenyl)-3-thiophen-2-yl-5-[(E)-2-thiophen-2-ylethenyl]-3,4-dihydropyrazole


SKU Product Name Product Unit Qty Supplier Email
User Name
User Email
Additional Comments