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144025-12-7

144025-12-7 | 1(2H)-Pyridinepropanamide, 3,6-dihydro-4-phenyl-N-(phenylmethyl)-

CAS No: 144025-12-7 Catalog No: AG001ISY MDL No:

Product Description

Catalog Number:
AG001ISY
Chemical Name:
1(2H)-Pyridinepropanamide, 3,6-dihydro-4-phenyl-N-(phenylmethyl)-
CAS Number:
144025-12-7
Molecular Formula:
C21H24N2O
Molecular Weight:
320.4281
IUPAC Name:
N-benzyl-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propanamide
InChI:
InChI=1S/C21H24N2O/c24-21(22-17-18-7-3-1-4-8-18)13-16-23-14-11-20(12-15-23)19-9-5-2-6-10-19/h1-11H,12-17H2,(H,22,24)
InChI Key:
LBWOTVQUFHARSN-UHFFFAOYSA-N
SMILES:
O=C(NCc1ccccc1)CCN1CCC(=CC1)c1ccccc1
NSC Number:
142503

Properties

Complexity:
420  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.189g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
320.436g/mol
Monoisotopic Mass:
320.189g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

Literature

Title Journal
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

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