200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 827015-28-1
827015-28-1 | 1H-Indole, 2-(3-methoxyphenyl)-3-[(4-phenyl-1-piperidinyl)methyl]-
CAS No: 827015-28-1 Catalog No: AG004WML MDL No:
Product Description
Catalog Number:
AG004WML
Chemical Name:
1H-Indole, 2-(3-methoxyphenyl)-3-[(4-phenyl-1-piperidinyl)methyl]-
CAS Number:
827015-28-1
Molecular Formula:
C27H28N2O
Molecular Weight:
396.5240
IUPAC Name:
2-(3-methoxyphenyl)-3-[(4-phenylpiperidin-1-yl)methyl]-1H-indole
InChI:
InChI=1S/C27H28N2O/c1-30-23-11-7-10-22(18-23)27-25(24-12-5-6-13-26(24)28-27)19-29-16-14-21(15-17-29)20-8-3-2-4-9-20/h2-13,18,21,28H,14-17,19H2,1H3
InChI Key:
WHUYHFLZXBRTBI-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)c1[nH]c2c(c1CN1CCC(CC1)c1ccccc1)cccc2
Properties
Complexity:
525
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
396.22g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
396.534g/mol
Monoisotopic Mass:
396.22g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
28.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.