200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 145131-58-4
145131-58-4 | Urea, N'-[2,6-bis(1-methylethyl)phenyl]-N-methyl-N-[[1-(1-methyl-1H-indol-3-yl)cyclopentyl]methyl]-
CAS No: 145131-58-4 Catalog No: AG001KMG MDL No:
Product Description
Catalog Number:
AG001KMG
Chemical Name:
Urea, N'-[2,6-bis(1-methylethyl)phenyl]-N-methyl-N-[[1-(1-methyl-1H-indol-3-yl)cyclopentyl]methyl]-
CAS Number:
145131-58-4
Molecular Formula:
C29H39N3O
Molecular Weight:
445.6395
IUPAC Name:
3-[2,6-di(propan-2-yl)phenyl]-1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea
InChI:
InChI=1S/C29H39N3O/c1-20(2)22-13-11-14-23(21(3)4)27(22)30-28(33)32(6)19-29(16-9-10-17-29)25-18-31(5)26-15-8-7-12-24(25)26/h7-8,11-15,18,20-21H,9-10,16-17,19H2,1-6H3,(H,30,33)
InChI Key:
UJWKCRLQJIAEGM-UHFFFAOYSA-N
SMILES:
CN(C(=O)Nc1c(cccc1C(C)C)C(C)C)CC1(CCCC1)c1cn(c2c1cccc2)C
Properties
Complexity:
639
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
445.309g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
445.651g/mol
Monoisotopic Mass:
445.309g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.