Home Nitros 2-Morpholin-4-yl-8-nitroquinoline

2-Morpholin-4-yl-8-nitroquinoline

CAS No.:
79638-54-3
Catalog Number:
AG0057LT
Molecular Formula:
C13H13N3O3
Molecular Weight:
259.2606
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG0057LT
Chemical Name:
2-Morpholin-4-yl-8-nitroquinoline
CAS Number:
79638-54-3
Molecular Formula:
C13H13N3O3
Molecular Weight:
259.2606
MDL Number:
MFCD00631977
IUPAC Name:
4-(2-hydroxyphenyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid
InChI:
InChI=1S/C13H13N3O3/c17-10-4-2-1-3-7(10)11-12-8(14-6-15-12)5-9(16-11)13(18)19/h1-4,6,9,11,16-17H,5H2,(H,14,15)(H,18,19)
InChI Key:
WHUQCPQHHXPQDJ-UHFFFAOYSA-N
SMILES:
OC(=O)C1NC(c2ccccc2O)c2c(C1)[nH]cn2
Properties
Complexity:
352  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.096g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
259.265g/mol
Monoisotopic Mass:
259.096g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
98.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties