Name: Name:Ethyl 6-fluoro-1-methyl-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-[1,3]thiazeto[3,2-a]quinoline-3-carboxylate
Brand: Angene
SKU: AG007RGH
Rating: 90 (10 reviews)

Ethyl 6-fluoro-1-methyl-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-[1,3]thiazeto[3,2-a]quinoline-3-carboxylate

CAS No.:

113028-17-4

Catalog Number:

AG007RGH

Molecular Formula:

C18H20FN3O3S

Molecular Weight:

377.4331

Catalog Number:

AG007RGH

Chemical Name:

Ethyl 6-fluoro-1-methyl-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-[1,3]thiazeto[3,2-a]quinoline-3-carboxylate

CAS Number:

113028-17-4

Molecular Formula:

C18H20FN3O3S

Molecular Weight:

377.4331

MDL Number:

MFCD08063938

IUPAC Name:

ethyl 6-fluoro-1-methyl-4-oxo-7-piperazin-1-yl-1H-[1,3]thiazeto[3,2-a]quinoline-3-carboxylate

InChI:

InChI=1S/C18H20FN3O3S/c1-3-25-18(24)15-16(23)11-8-12(19)14(21-6-4-20-5-7-21)9-13(11)22-10(2)26-17(15)22/h8-10,20H,3-7H2,1-2H3

InChI Key:

XWZXETKTFKCCPB-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1c2SC(n2c2c(c1=O)cc(c(c2)N1CCNCC1)F)C

EC Number:

601-222-6

Complexity:

637

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

377.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

377.434g/mol

Monoisotopic Mass:

377.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

87.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7