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Home > Pyridines > 158942-04-2

158942-04-2

158942-04-2 | Benzo[1,2-b:4,5-b']dipyrrole-1(2H)-carboxamide, 3,5-dihydro-5-methyl-N-3-pyridinyl-

CAS No: 158942-04-2 Catalog No: AG001R11 MDL No:

Product Description

Catalog Number:
AG001R11
Chemical Name:
Benzo[1,2-b:4,5-b']dipyrrole-1(2H)-carboxamide, 3,5-dihydro-5-methyl-N-3-pyridinyl-
CAS Number:
158942-04-2
Molecular Formula:
C17H16N4O
Molecular Weight:
292.3351
IUPAC Name:
1-methyl-N-pyridin-3-yl-6,7-dihydropyrrolo[2,3-f]indole-5-carboxamide
InChI:
InChI=1S/C17H16N4O/c1-20-7-4-12-10-16-13(9-15(12)20)5-8-21(16)17(22)19-14-3-2-6-18-11-14/h2-4,6-7,9-11H,5,8H2,1H3,(H,19,22)
InChI Key:
QJQORSLQNXDVGE-UHFFFAOYSA-N
SMILES:
O=C(N1CCc2c1cc1ccn(c1c2)C)Nc1cccnc1
UNII:
AL4387525T

Properties

Complexity:
429  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.132g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
292.342g/mol
Monoisotopic Mass:
292.132g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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