200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 138964-86-0
138964-86-0 | 8a(1H)-Indolizinol, 6-(3,4-dimethoxyphenyl)-2,3,5,6-tetrahydro-7-(4-methoxyphenyl)-, (6R,8aR)-
CAS No: 138964-86-0 Catalog No: AG0019XA MDL No:
Product Description
Catalog Number:
AG0019XA
Chemical Name:
8a(1H)-Indolizinol, 6-(3,4-dimethoxyphenyl)-2,3,5,6-tetrahydro-7-(4-methoxyphenyl)-, (6R,8aR)-
CAS Number:
138964-86-0
Molecular Formula:
C23H27NO4
Molecular Weight:
381.4648
IUPAC Name:
(6R,8aR)-6-(3,4-dimethoxyphenyl)-7-(4-methoxyphenyl)-2,3,5,6-tetrahydro-1H-indolizin-8a-ol
InChI:
InChI=1S/C23H27NO4/c1-26-18-8-5-16(6-9-18)19-14-23(25)11-4-12-24(23)15-20(19)17-7-10-21(27-2)22(13-17)28-3/h5-10,13-14,20,25H,4,11-12,15H2,1-3H3/t20-,23-/m1/s1
InChI Key:
WHTUBPJAGYKOQP-NFBKMPQASA-N
SMILES:
COc1ccc(cc1)C1=C[C@]2(O)CCCN2C[C@@H]1c1ccc(c(c1)OC)OC
NSC Number:
650393
Properties
Complexity:
559
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
381.194g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
381.472g/mol
Monoisotopic Mass:
381.194g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.