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Home > Pyridines > 1092344-97-2
1092344-97-2 | 5-methyl-1H,2H,7H-pyrido[3,2-d][1,2]diazepin-2-one
CAS No: 1092344-97-2 Catalog No: AG00IS18 MDL No:MFCD11501765
Product Description
Catalog Number:
AG00IS18
Chemical Name:
5-methyl-1H,2H,7H-pyrido[3,2-d][1,2]diazepin-2-one
CAS Number:
1092344-97-2
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
MDL Number:
MFCD11501765
IUPAC Name:
5-methyl-1,7-dihydropyrido[3,2-d]diazepin-2-one
InChI:
InChI=1S/C9H9N3O/c1-6-7-2-3-9(13)11-8(7)4-5-10-12-6/h2-5,10H,1H3,(H,11,13)
InChI Key:
KGRLFHGKJKNTDO-UHFFFAOYSA-N
SMILES:
O=c1ccc2c([nH]1)cc[nH]nc2C
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.075g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
175.191g/mol
Monoisotopic Mass:
175.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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