AC1NX1D2 structure

AC1NX1D2

N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-5-(3-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

Also Known As: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-5-(3-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide|N-(3-cyano(4,5,6-trihydrocyclopenta[1,2-d]thiophen-2-yl))[5-(3-methoxyphenyl)- 7-(trifluoromethyl)(4H,5H,6H,7H-pyrazolo[1,5-a]1,3-diazaperhydroin-2-yl)]carbo xamide|N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-5-(3-methoxyphenyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

CAS: 830348-44-2
Molecular Formula C23H20F3N5O2S
Molecular Weight 487.12897 g/mol
LogP 5.22618
Topological Polar Surface Area 91.97 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 487.12897
Monoisotopic Mass 487.12897
Heavy Atoms 34
Complexity 1306.898

Chemical Identifiers

CAS Number 830348-44-2
SMILES COC1=CC=CC(=C1)C2CC(N3C(=CC(=N3)C(=O)NC4=C(C5=C(S4)CCC5)C#N)N2)C(F)(F)F

Product Overview

AC1NX1D2 (CAS 830348-44-2), with molecular formula C23H20F3N5O2S and molecular weight 487.12897 g/mol. IUPAC: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-5-(3-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide.

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