200,000+ products from a single source!
sales@angenechem.com
854306-71-1 | PHENOL, 4-METHYL-2-[3-[(1-METHYLETHYL)[3-[5-METHYL-2-(PHENYLMETHOXY)PHENYL]-3-PHENYLPROPYL]AMINO]-1-PHENYLPROPYL]-
CAS No: 854306-71-1 Catalog No: AG004JY2 MDL No:
Product Description
Catalog Number:
AG004JY2
Chemical Name:
PHENOL, 4-METHYL-2-[3-[(1-METHYLETHYL)[3-[5-METHYL-2-(PHENYLMETHOXY)PHENYL]-3-PHENYLPROPYL]AMINO]-1-PHENYLPROPYL]-
CAS Number:
854306-71-1
Molecular Formula:
C42H47NO2
Molecular Weight:
597.8281
IUPAC Name:
4-methyl-2-[3-[[3-(5-methyl-2-phenylmethoxyphenyl)-3-phenylpropyl]-propan-2-ylamino]-1-phenylpropyl]phenol
InChI:
InChI=1S/C42H47NO2/c1-31(2)43(26-24-37(35-16-10-6-11-17-35)39-28-32(3)20-22-41(39)44)27-25-38(36-18-12-7-13-19-36)40-29-33(4)21-23-42(40)45-30-34-14-8-5-9-15-34/h5-23,28-29,31,37-38,44H,24-27,30H2,1-4H3
InChI Key:
GXNHCHFPSIESSQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C(c1ccccc1)CCN(C(C)C)CCC(c1cc(C)ccc1O)c1ccccc1)OCc1ccccc1
Properties
Complexity:
797
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
597.361g/mol
Formal Charge:
0
Heavy Atom Count:
45
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
597.843g/mol
Monoisotopic Mass:
597.361g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
10.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.