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ethyl 5-(3-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate

ethyl 5-(3-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate

CAS: 514799-10-1

Formula: C17H14F3N3O3

SMILES: CCOC(=O)C1=C2N=C(C=C(N2N=C1)C(F)(F)F)C1=CC(OC)=CC=C1

IUPAC: ethyl 5-(3-methoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate

InChI: InChI=1S/C17H14F3N3O3/c1-3-26-16(24)12-9-21-23-14(17(18,19)20)8-13(22-15(12)23)10-5-4-6-11(7-10)25-2/h4-9H,3H2,1-2H3

Composition: C (55.89%), H (3.86%), F (15.60%), N (11.50%), O (13.14%)

Molar Mass: 365.312

Atom Count: 40

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 365.098725812
Formal Charge 0
FSP3 0.24
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey HBTPQFUDMAKKQZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 97.63
Topological Polar Surface Area 65.72
Polarizability 33.24
Ring Count 3
Rotatable Bond Count 6

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 514799-10-1 $202.14$202.14
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