5-(5-methylthiophen-2-yl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine

5-(5-methylthiophen-2-yl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine

CAS: 861443-59-6

Formula: C12H12F3N3S

SMILES: CC1=CC=C(S1)C1CC(N2N=CC=C2N1)C(F)(F)F

IUPAC: 5-(5-methylthiophen-2-yl)-7-(trifluoromethyl)-4H,5H,6H,7H-pyrazolo[1,5-a]pyrimidine

InChI: InChI=1/C12H12F3N3S/c1-7-2-3-9(19-7)8-6-10(12(13,14)15)18-11(17-8)4-5-16-18/h2-5,8,10,17H,6H2,1H3

Composition: C (50.17%), H (4.21%), F (19.84%), N (14.63%), S (11.16%)

Molar Mass: 287.3

Atom Count: 31

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	2
Exact Mass	287.070403061
Formal Charge	0
FSP3	0.42
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	XVDUXCIJVMKPGD-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	78.65
Topological Polar Surface Area	29.85
Polarizability	24.25
Ring Count	3
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	861443-59-6		$254.80$254.80