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Home > Pyridines > 126874-65-5
126874-65-5 | 11H-Pyrido[2,1-b]quinazolin-11-one, 8-(1-methylethyl)-2-(2H-tetrazol-5-yl)-
CAS No: 126874-65-5 Catalog No: AG000TEQ MDL No:
Product Description
Catalog Number:
AG000TEQ
Chemical Name:
11H-Pyrido[2,1-b]quinazolin-11-one, 8-(1-methylethyl)-2-(2H-tetrazol-5-yl)-
CAS Number:
126874-65-5
Molecular Formula:
C16H14N6O
Molecular Weight:
306.3220
IUPAC Name:
8-propan-2-yl-2-(2H-tetrazol-5-yl)pyrido[2,1-b]quinazolin-11-one
InChI:
InChI=1S/C16H14N6O/c1-9(2)11-4-6-14-17-13-5-3-10(15-18-20-21-19-15)7-12(13)16(23)22(14)8-11/h3-9H,1-2H3,(H,18,19,20,21)
InChI Key:
PLMCTCFGZLOZKC-UHFFFAOYSA-N
SMILES:
CC(c1ccc2n(c1)c(=O)c1c(n2)ccc(c1)c1n[nH]nn1)C
Properties
Complexity:
595
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.123g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
306.329g/mol
Monoisotopic Mass:
306.123g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
87.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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