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Home > Pyridines > 1384591-76-7
1384591-76-7 | 1H,2H,3H,4H,5H-pyrido[2,3-b][1,4]diazepine
CAS No: 1384591-76-7 Catalog No: AG019ZON MDL No:MFCD22375280
Product Description
Catalog Number:
AG019ZON
Chemical Name:
1H,2H,3H,4H,5H-pyrido[2,3-b][1,4]diazepine
CAS Number:
1384591-76-7
Molecular Formula:
C8H11N3
Molecular Weight:
149.1930
MDL Number:
MFCD22375280
IUPAC Name:
2,3,4,5-tetrahydro-1H-pyrido[2,3-b][1,4]diazepine
InChI:
InChI=1S/C8H11N3/c1-3-7-8(10-4-1)11-6-2-5-9-7/h1,3-4,9H,2,5-6H2,(H,10,11)
InChI Key:
HABVSSGSPKPJIP-UHFFFAOYSA-N
SMILES:
C1CNc2c(NC1)cccn2
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.095g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
149.197g/mol
Monoisotopic Mass:
149.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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