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Home > Pyridines > 1186194-55-7
1186194-55-7 | 10a-phenyl-decahydropyrido[1,2-a][1,3]diazepin-7-one
CAS No: 1186194-55-7 Catalog No: AG00JWDY MDL No:MFCD12547112
Product Description
Catalog Number:
AG00JWDY
Chemical Name:
10a-phenyl-decahydropyrido[1,2-a][1,3]diazepin-7-one
CAS Number:
1186194-55-7
Molecular Formula:
C15H20N2O
Molecular Weight:
244.3321
MDL Number:
MFCD12547112
IUPAC Name:
10a-phenyl-1,2,3,4,5,8,9,10-octahydropyrido[1,2-a][1,3]diazepin-7-one
InChI:
InChI=1S/C15H20N2O/c18-14-9-6-10-15(13-7-2-1-3-8-13)16-11-4-5-12-17(14)15/h1-3,7-8,16H,4-6,9-12H2
InChI Key:
OWXBAYLITTYOKA-UHFFFAOYSA-N
SMILES:
O=C1CCCC2(N1CCCCN2)c1ccccc1
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.158g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.338g/mol
Monoisotopic Mass:
244.158g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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