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151327-12-7

151327-12-7 | Pyrazolo[1,5-a]pyrimidin-7-amine, 5-propyl-6-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-

CAS No: 151327-12-7 Catalog No: AG001NA5 MDL No:

Product Description

Catalog Number:
AG001NA5
Chemical Name:
Pyrazolo[1,5-a]pyrimidin-7-amine, 5-propyl-6-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-
CAS Number:
151327-12-7
Molecular Formula:
C23H22N8
Molecular Weight:
410.4744
IUPAC Name:
5-propyl-6-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]pyrazolo[1,5-a]pyrimidin-7-amine
InChI:
InChI=1S/C23H22N8/c1-2-5-20-19(22(24)31-21(26-20)12-13-25-31)14-15-8-10-16(11-9-15)17-6-3-4-7-18(17)23-27-29-30-28-23/h3-4,6-13H,2,5,14,24H2,1H3,(H,27,28,29,30)
InChI Key:
YNQMEWUGNXUQCV-UHFFFAOYSA-N
SMILES:
CCCc1nc2ccnn2c(c1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)N

Properties

Complexity:
568  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
410.197g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
410.485g/mol
Monoisotopic Mass:
410.197g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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