Home Other Building Blocks 2-phenyl-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

2-phenyl-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine

CAS No.:
1695838-78-8
Catalog Number:
AG01CA5N
Molecular Formula:
C11H12N4
Molecular Weight:
200.2398
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Product Description
Catalog Number:
AG01CA5N
Chemical Name:
2-phenyl-4H,5H,6H,7H-[1,2,4]triazolo[1,5-a]pyrimidine
CAS Number:
1695838-78-8
Molecular Formula:
C11H12N4
Molecular Weight:
200.2398
MDL Number:
MFCD28525940
IUPAC Name:
2-phenyl-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidine
InChI:
InChI=1S/C11H12N4/c1-2-5-9(6-3-1)10-13-11-12-7-4-8-15(11)14-10/h1-3,5-6H,4,7-8H2,(H,12,13,14)
InChI Key:
YGUAIWIZODZOSZ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1nn2c(n1)NCCC2
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.106g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.245g/mol
Monoisotopic Mass:
200.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties