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138192-21-9 | Pyrido[1,2-a][1,3]diazepine, 1,2,3,4,5,7,8,9-octahydro-
CAS No: 138192-21-9 Catalog No: AG00185C MDL No:
Product Description
Catalog Number:
AG00185C
Chemical Name:
Pyrido[1,2-a][1,3]diazepine, 1,2,3,4,5,7,8,9-octahydro-
CAS Number:
138192-21-9
Molecular Formula:
C9H16N2
Molecular Weight:
152.2367
IUPAC Name:
1,2,3,4,5,7,8,9-octahydropyrido[1,2-a][1,3]diazepine
InChI:
InChI=1S/C9H16N2/c1-3-7-11-8-4-2-6-10-9(11)5-1/h5,10H,1-4,6-8H2
InChI Key:
WVFDUZNAUQLQQP-UHFFFAOYSA-N
SMILES:
C1CCN2C(=CCCC2)NC1
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.131g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
152.241g/mol
Monoisotopic Mass:
152.131g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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