200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 28717-19-3
28717-19-3 | 1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-6-methoxy-1-(3-pyridinyl)-, hydrochloride (1:1)
CAS No: 28717-19-3 Catalog No: AG002W7X MDL No:
Product Description
Catalog Number:
AG002W7X
Chemical Name:
1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro-6-methoxy-1-(3-pyridinyl)-, hydrochloride (1:1)
CAS Number:
28717-19-3
Molecular Formula:
C17H18ClN3O
Molecular Weight:
315.7973
IUPAC Name:
6-methoxy-1-pyridin-3-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole;hydrochloride
InChI:
InChI=1S/C17H17N3O.ClH/c1-21-12-4-5-15-14(9-12)13-6-8-19-16(17(13)20-15)11-3-2-7-18-10-11;/h2-5,7,9-10,16,19-20H,6,8H2,1H3;1H
InChI Key:
DXDICBIRAVOVNI-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c1CCNC(c1[nH]2)c1cccnc1.Cl
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.114g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
315.801g/mol
Monoisotopic Mass:
315.114g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.