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Home > Pyridines > 138768-70-4
138768-70-4 | Ethanone, 1-(2,3,4,5-tetrahydro-5-methyl-1H-pyrido[2,3-b][1,4]diazepin-1-yl)-
CAS No: 138768-70-4 Catalog No: AG0019I2 MDL No:
Product Description
Catalog Number:
AG0019I2
Chemical Name:
Ethanone, 1-(2,3,4,5-tetrahydro-5-methyl-1H-pyrido[2,3-b][1,4]diazepin-1-yl)-
CAS Number:
138768-70-4
Molecular Formula:
C11H15N3O
Molecular Weight:
205.2563
IUPAC Name:
1-(5-methyl-3,4-dihydro-2H-pyrido[2,3-b][1,4]diazepin-1-yl)ethanone
InChI:
InChI=1S/C11H15N3O/c1-9(15)14-8-4-7-13(2)11-10(14)5-3-6-12-11/h3,5-6H,4,7-8H2,1-2H3
InChI Key:
IMLCYQZQFUFZLN-UHFFFAOYSA-N
SMILES:
CC(=O)N1CCCN(c2c1cccn2)C
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.122g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.261g/mol
Monoisotopic Mass:
205.122g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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