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119464-16-3

119464-16-3 | 2H,6H-Pyrido[1'',2'':3',4']imidazo[1',5':1,2]pyrido[3,4-b]indole, 6-(2,3-dimethoxyphenyl)-1,3,4,8,9,14,14b,14c-octahydro-

CAS No: 119464-16-3 Catalog No: AG000IU8 MDL No:

Product Description

Catalog Number:
AG000IU8
Chemical Name:
2H,6H-Pyrido[1'',2'':3',4']imidazo[1',5':1,2]pyrido[3,4-b]indole, 6-(2,3-dimethoxyphenyl)-1,3,4,8,9,14,14b,14c-octahydro-
CAS Number:
119464-16-3
Molecular Formula:
C25H29N3O2
Molecular Weight:
403.5167
IUPAC Name:
9-(2,3-dimethoxyphenyl)-8,10,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),14,16,18-tetraene
InChI:
InChI=1S/C25H29N3O2/c1-29-21-12-7-9-18(24(21)30-2)25-27-14-6-5-11-20(27)23-22-17(13-15-28(23)25)16-8-3-4-10-19(16)26-22/h3-4,7-10,12,20,23,25-26H,5-6,11,13-15H2,1-2H3
InChI Key:
UGEUDCCVECRBFX-UHFFFAOYSA-N
SMILES:
COc1c(OC)cccc1C1N2CCCCC2C2N1CCc1c2[nH]c2c1cccc2

Properties

Complexity:
617  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.226g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
403.526g/mol
Monoisotopic Mass:
403.226g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  

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