200,000+ products from a single source!
sales@angenechem.com
124476-81-9 | 1H-Pyrrolo[2,3-b]pyridine-5-carbonitrile, 4,6-diamino-2,3-dihydro-2-oxo-1-phenyl-
CAS No: 124476-81-9 Catalog No: AG000M2Z MDL No:MFCD00496415
Product Description
Catalog Number:
AG000M2Z
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-5-carbonitrile, 4,6-diamino-2,3-dihydro-2-oxo-1-phenyl-
CAS Number:
124476-81-9
Molecular Formula:
C14H11N5O
Molecular Weight:
265.2700
MDL Number:
MFCD00496415
IUPAC Name:
4,6-diamino-2-oxo-1-phenyl-3H-pyrrolo[2,3-b]pyridine-5-carbonitrile
InChI:
InChI=1S/C14H11N5O/c15-7-10-12(16)9-6-11(20)19(14(9)18-13(10)17)8-4-2-1-3-5-8/h1-5H,6H2,(H4,16,17,18)
InChI Key:
HOVPHPWNBCZIGP-UHFFFAOYSA-N
SMILES:
N#Cc1c(N)nc2c(c1N)CC(=O)N2c1ccccc1
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.096g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
265.276g/mol
Monoisotopic Mass:
265.096g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.