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129299-72-5

129299-72-5 | 10-methyl-7-((5-methyl-1H-imidazol-4-yl)methyl)-8,9-dihydropyrido[1,2-a]indol-6(7H)-one

CAS No: 129299-72-5 Catalog No: AG01DJ8D MDL No:

Product Description

Catalog Number:
AG01DJ8D
Chemical Name:
10-methyl-7-((5-methyl-1H-imidazol-4-yl)methyl)-8,9-dihydropyrido[1,2-a]indol-6(7H)-one
CAS Number:
129299-72-5
Molecular Formula:
C18H19N3O
Molecular Weight:
293.3630
IUPAC Name:
10-methyl-7-[(5-methyl-1H-imidazol-4-yl)methyl]-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one
InChI:
InChI=1S/C18H19N3O/c1-11-14-5-3-4-6-17(14)21-16(11)8-7-13(18(21)22)9-15-12(2)19-10-20-15/h3-6,10,13H,7-9H2,1-2H3,(H,19,20)
InChI Key:
AEKQMJRJRAHOAP-UHFFFAOYSA-N
SMILES:
Cc1[nH]cnc1CC1CCc2n(C1=O)c1ccccc1c2C

Properties

Complexity:
440  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.153g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
293.37g/mol
Monoisotopic Mass:
293.153g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

Literature

Title Journal
Antiemetic activity of FK1052, a 5-HT3- and 5-HT4-receptor antagonist, in Suncus murinus and ferrets. Journal of pharmacological sciences 20050801
Utility of hepatocytes in predicting drug metabolism: comparison of hepatic intrinsic clearance in rats and humans in vivo and in vitro. Drug metabolism and disposition: the biological fate of chemicals 20030501
Prediction of human hepatic clearance from in vivo animal experiments and in vitro metabolic studies with liver microsomes from animals and humans. Drug metabolism and disposition: the biological fate of chemicals 20011001
Participation of 5-HT3, 5-HT4, and nicotinic receptors in the peristaltic reflex of guinea pig distal colon. The American journal of physiology 19961101

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