Name: Name:2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]acetic acid
Brand: Angene
SKU: AG019L1Z
Rating: 90 (10 reviews)

2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]acetic acid

CAS No.:

946666-76-8

Catalog Number:

AG019L1Z

Molecular Formula:

C9H8N2O3S2

Molecular Weight:

256.3014

Catalog Number:

AG019L1Z

Chemical Name:

2-[({5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-7-yl}methyl)sulfanyl]acetic acid

CAS Number:

946666-76-8

Molecular Formula:

C9H8N2O3S2

Molecular Weight:

256.3014

MDL Number:

MFCD09971342

IUPAC Name:

2-[(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methylsulfanyl]acetic acid

InChI:

InChI=1S/C9H8N2O3S2/c12-7-3-6(4-15-5-8(13)14)10-9-11(7)1-2-16-9/h1-3H,4-5H2,(H,13,14)

InChI Key:

YBLIDSVDNAXNKL-UHFFFAOYSA-N

SMILES:

OC(=O)CSCc1cc(=O)n2c(n1)scc2

Complexity:

429

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

255.998g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

256.294g/mol

Monoisotopic Mass:

255.998g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

121A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2