sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks Benzeneacetic acid, 4-[(1R)-1-hydroxy-4-[4-(hydroxydiphenylmethyl)-1-piperidinyl]butyl]-α,α-dimethyl-

Benzeneacetic acid, 4-[(1R)-1-hydroxy-4-[4-(hydroxydiphenylmethyl)-1-piperidinyl]butyl]-α,α-dimethyl-

CAS No.:
139965-10-9
Catalog Number:
AG001BW2
Molecular Formula:
C32H39NO4
Molecular Weight:
501.6564
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG001BW2
Chemical Name:
Benzeneacetic acid, 4-[(1R)-1-hydroxy-4-[4-(hydroxydiphenylmethyl)-1-piperidinyl]butyl]-α,α-dimethyl-
CAS Number:
139965-10-9
Molecular Formula:
C32H39NO4
Molecular Weight:
501.6564
MDL Number:
MFCD09840618
IUPAC Name:
2-[4-[(1R)-1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid
InChI:
InChI=1S/C32H39NO4/c1-31(2,30(35)36)25-17-15-24(16-18-25)29(34)14-9-21-33-22-19-28(20-23-33)32(37,26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-8,10-13,15-18,28-29,34,37H,9,14,19-23H2,1-2H3,(H,35,36)/t29-/m1/s1
InChI Key:
RWTNPBWLLIMQHL-GDLZYMKVSA-N
SMILES:
OC(=O)C(c1ccc(cc1)[C@@H](CCCN1CCC(CC1)C(c1ccccc1)(c1ccccc1)O)O)(C)C
Properties
Complexity:
678  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
501.288g/mol
Formal Charge:
0
Heavy Atom Count:
37  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
501.667g/mol
Monoisotopic Mass:
501.288g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
81A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Literature
Title Journal
A review of antihistamines used during pregnancy. Journal of pharmacology & pharmacotherapeutics 20120101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Review of fexofenadine in the treatment of chronic idiopathic urticaria. International journal of dermatology 20021001
Pharmacological rescue of human K(+) channel long-QT2 mutations: human ether-a-go-go-related gene rescue without block. Circulation 20020618
Pharmacokinetic profile of zafirlukast. Clinical pharmacokinetics 20020101
Loratadine and terfenadine interaction with nefazodone: Both antihistamines are associated with QTc prolongation. Clinical pharmacology and therapeutics 20010301
Properties