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119464-20-9 | 2H,6H-Pyrido[1'',2'':3',4']imidazo[1',5':1,2]pyrido[3,4-b]indole, 1,3,4,8,9,14,14b,14c-octahydro-6-(4-pyridinyl)-
CAS No: 119464-20-9 Catalog No: AG000IU7 MDL No:
Product Description
Catalog Number:
AG000IU7
Chemical Name:
2H,6H-Pyrido[1'',2'':3',4']imidazo[1',5':1,2]pyrido[3,4-b]indole, 1,3,4,8,9,14,14b,14c-octahydro-6-(4-pyridinyl)-
CAS Number:
119464-20-9
Molecular Formula:
C22H24N4
Molecular Weight:
344.4528
IUPAC Name:
9-pyridin-4-yl-8,10,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),14,16,18-tetraene
InChI:
InChI=1S/C22H24N4/c1-2-6-18-16(5-1)17-10-14-26-21(20(17)24-18)19-7-3-4-13-25(19)22(26)15-8-11-23-12-9-15/h1-2,5-6,8-9,11-12,19,21-22,24H,3-4,7,10,13-14H2
InChI Key:
OIROQHWNXZSXST-UHFFFAOYSA-N
SMILES:
n1ccc(cc1)C1N2CCCCC2C2N1CCc1c2[nH]c2c1cccc2
NSC Number:
631407
Properties
Complexity:
518
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.2g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
344.462g/mol
Monoisotopic Mass:
344.2g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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