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Home > Pyridines > 880770-84-3
880770-84-3 | 1H-Pyrrolo[2,3-b]pyridine, 3-[3-(cyclopentyloxy)-4-methoxyphenyl]-
CAS No: 880770-84-3 Catalog No: AG004KGQ MDL No:
Product Description
Catalog Number:
AG004KGQ
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 3-[3-(cyclopentyloxy)-4-methoxyphenyl]-
CAS Number:
880770-84-3
Molecular Formula:
C19H20N2O2
Molecular Weight:
308.3743
IUPAC Name:
3-(3-cyclopentyloxy-4-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C19H20N2O2/c1-22-17-9-8-13(11-18(17)23-14-5-2-3-6-14)16-12-21-19-15(16)7-4-10-20-19/h4,7-12,14H,2-3,5-6H2,1H3,(H,20,21)
InChI Key:
IURBVLNXRATABP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OC1CCCC1)c1c[nH]c2c1cccn2
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.152g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
308.381g/mol
Monoisotopic Mass:
308.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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