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Home > Indoles and Oxindole > 138188-62-2
138188-62-2 | 9H-Pyrido[3,4-b]indol-4-ol, 1-ethyl-9-(phenylmethyl)-
CAS No: 138188-62-2 Catalog No: AG00185K MDL No:
Product Description
Catalog Number:
AG00185K
Chemical Name:
9H-Pyrido[3,4-b]indol-4-ol, 1-ethyl-9-(phenylmethyl)-
CAS Number:
138188-62-2
Molecular Formula:
C20H18N2O
Molecular Weight:
302.3697
IUPAC Name:
9-benzyl-1-ethylpyrido[3,4-b]indol-4-ol
InChI:
InChI=1S/C20H18N2O/c1-2-16-20-19(18(23)12-21-16)15-10-6-7-11-17(15)22(20)13-14-8-4-3-5-9-14/h3-12,23H,2,13H2,1H3
InChI Key:
OFUIZDFZBCKSLD-UHFFFAOYSA-N
SMILES:
CCc1ncc(c2c1n(Cc1ccccc1)c1c2cccc1)O
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.142g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
302.377g/mol
Monoisotopic Mass:
302.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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