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100139-31-9 | 2-Quinazolinepropanoic acid, 3-amino-3,4-dihydro-8-methoxy-4-oxo-, hydrazide
CAS No: 100139-31-9 Catalog No: AG000130 MDL No:
Product Description
Catalog Number:
AG000130
Chemical Name:
2-Quinazolinepropanoic acid, 3-amino-3,4-dihydro-8-methoxy-4-oxo-, hydrazide
CAS Number:
100139-31-9
Molecular Formula:
C12H15N5O3
Molecular Weight:
277.2792
IUPAC Name:
3-(3-amino-8-methoxy-4-oxoquinazolin-2-yl)propanehydrazide
InChI:
InChI=1S/C12H15N5O3/c1-20-8-4-2-3-7-11(8)15-9(17(14)12(7)19)5-6-10(18)16-13/h2-4H,5-6,13-14H2,1H3,(H,16,18)
InChI Key:
MOSJPJNJOLFHMP-UHFFFAOYSA-N
SMILES:
NNC(=O)CCc1nc2c(OC)cccc2c(=O)n1N
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.117g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
277.284g/mol
Monoisotopic Mass:
277.117g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
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