200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 126312-13-8
126312-13-8 | Urea, N-[2,6-bis(1-methylethyl)phenyl]-N'-(2,2-diphenylethyl)-
CAS No: 126312-13-8 Catalog No: AG000SJU MDL No:
Product Description
Catalog Number:
AG000SJU
Chemical Name:
Urea, N-[2,6-bis(1-methylethyl)phenyl]-N'-(2,2-diphenylethyl)-
CAS Number:
126312-13-8
Molecular Formula:
C27H32N2O
Molecular Weight:
400.5558
IUPAC Name:
1-(2,2-diphenylethyl)-3-[2,6-di(propan-2-yl)phenyl]urea
InChI:
InChI=1S/C27H32N2O/c1-19(2)23-16-11-17-24(20(3)4)26(23)29-27(30)28-18-25(21-12-7-5-8-13-21)22-14-9-6-10-15-22/h5-17,19-20,25H,18H2,1-4H3,(H2,28,29,30)
InChI Key:
MGQJSBZOPBVNER-UHFFFAOYSA-N
SMILES:
O=C(Nc1c(cccc1C(C)C)C(C)C)NCC(c1ccccc1)c1ccccc1
Properties
Complexity:
471
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
400.251g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
400.566g/mol
Monoisotopic Mass:
400.251g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.