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876708-23-5 | 4-PYRIDIN-3-YL-4,5,6,7-TETRAHYDRO-3H-IMIDAZO[4,5-C]PYRIDINE
CAS No: 876708-23-5 Catalog No: AG004KVA MDL No:MFCD09749723
Product Description
Catalog Number:
AG004KVA
Chemical Name:
4-PYRIDIN-3-YL-4,5,6,7-TETRAHYDRO-3H-IMIDAZO[4,5-C]PYRIDINE
CAS Number:
876708-23-5
Molecular Formula:
C11H12N4
Molecular Weight:
200.2398
MDL Number:
MFCD09749723
IUPAC Name:
4-pyridin-3-yl-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine
InChI:
InChI=1S/C11H12N4/c1-2-8(6-12-4-1)10-11-9(3-5-13-10)14-7-15-11/h1-2,4,6-7,10,13H,3,5H2,(H,14,15)
InChI Key:
GBMWJSLSINTZJI-UHFFFAOYSA-N
SMILES:
c1ccc(cn1)C1NCCc2c1[nH]cn2
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.245g/mol
Monoisotopic Mass:
200.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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