Home Halogens 1,8-Naphthyridine-3-carboxylic acid, 7-chloro-1,4-dihydro-4-oxo-1-(2-thiazolyl)-, ethyl ester

1,8-Naphthyridine-3-carboxylic acid, 7-chloro-1,4-dihydro-4-oxo-1-(2-thiazolyl)-, ethyl ester

CAS No.:
174726-87-5
Catalog Number:
AG001ZWY
Molecular Formula:
C14H10ClN3O3S
Molecular Weight:
335.7655
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Product Description
Catalog Number:
AG001ZWY
Chemical Name:
1,8-Naphthyridine-3-carboxylic acid, 7-chloro-1,4-dihydro-4-oxo-1-(2-thiazolyl)-, ethyl ester
CAS Number:
174726-87-5
Molecular Formula:
C14H10ClN3O3S
Molecular Weight:
335.7655
MDL Number:
MFCD23100683
IUPAC Name:
ethyl 7-chloro-4-oxo-1-(1,3-thiazol-2-yl)-1,8-naphthyridine-3-carboxylate
InChI:
InChI=1S/C14H10ClN3O3S/c1-2-21-13(20)9-7-18(14-16-5-6-22-14)12-8(11(9)19)3-4-10(15)17-12/h3-7H,2H2,1H3
InChI Key:
DEQCQORBUCWBPB-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cn(c2nccs2)c2c(c1=O)ccc(n2)Cl
Properties
Complexity:
502  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.013g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
335.762g/mol
Monoisotopic Mass:
335.013g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties