200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 1704740-52-2
1704740-52-2 | (2S)-N-[4-[[3-Cyano-1-(2-methylpropyl)-1H-indol-5-yl]oxy]phenyl]-2-pyrrolidinecarboxamide
CAS No: 1704740-52-2 Catalog No: AG01ENJR MDL No:
Product Description
Catalog Number:
AG01ENJR
Chemical Name:
(2S)-N-[4-[[3-Cyano-1-(2-methylpropyl)-1H-indol-5-yl]oxy]phenyl]-2-pyrrolidinecarboxamide
CAS Number:
1704740-52-2
Molecular Formula:
C24H26N4O2
Molecular Weight:
402.4888
IUPAC Name:
(2S)-N-[4-[3-cyano-1-(2-methylpropyl)indol-5-yl]oxyphenyl]pyrrolidine-2-carboxamide
InChI:
InChI=1S/C24H26N4O2/c1-16(2)14-28-15-17(13-25)21-12-20(9-10-23(21)28)30-19-7-5-18(6-8-19)27-24(29)22-4-3-11-26-22/h5-10,12,15-16,22,26H,3-4,11,14H2,1-2H3,(H,27,29)/t22-/m0/s1
InChI Key:
OOGHGWKBJXQNEJ-QFIPXVFZSA-N
SMILES:
N#Cc1cn(c2c1cc(cc2)Oc1ccc(cc1)NC(=O)[C@@H]1CCCN1)CC(C)C
Properties
Complexity:
636
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
402.206g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
402.498g/mol
Monoisotopic Mass:
402.206g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
79.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.