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Home Other Building Blocks Carbamic acid, [1,1'-biphenyl]-2-yl-, 4-piperidinyl ester

Carbamic acid, [1,1'-biphenyl]-2-yl-, 4-piperidinyl ester

CAS No.:
171722-92-2
Catalog Number:
AG007WMR
Molecular Formula:
C18H20N2O2
Molecular Weight:
296.3636
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Product Description
Catalog Number:
AG007WMR
Chemical Name:
Carbamic acid, [1,1'-biphenyl]-2-yl-, 4-piperidinyl ester
CAS Number:
171722-92-2
Molecular Formula:
C18H20N2O2
Molecular Weight:
296.3636
MDL Number:
MFCD27964656
IUPAC Name:
piperidin-4-yl N-(2-phenylphenyl)carbamate
InChI:
InChI=1S/C18H20N2O2/c21-18(22-15-10-12-19-13-11-15)20-17-9-5-4-8-16(17)14-6-2-1-3-7-14/h1-9,15,19H,10-13H2,(H,20,21)
InChI Key:
AGZCCVMWUZINGV-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1c1ccccc1)OC1CCNCC1
EC Number:
605-615-3
Properties
Complexity:
349  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.152g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
296.37g/mol
Monoisotopic Mass:
296.152g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Discovery of muscarinic acetylcholine receptor antagonist and beta 2 adrenoceptor agonist (MABA) dual pharmacology molecules. Bioorganic & medicinal chemistry letters 20110301
Properties