Name: Name:methyl 4-hydroxy-7-isopropyl-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxylate
Brand: Angene
SKU: AG01DIA2
Rating: 90 (10 reviews)

methyl 4-hydroxy-7-isopropyl-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxylate

CAS No.:

869493-47-0

Catalog Number:

AG01DIA2

Molecular Formula:

C12H13NO4S

Molecular Weight:

267.3009

Catalog Number:

AG01DIA2

Chemical Name:

methyl 4-hydroxy-7-isopropyl-6-oxo-6,7-dihydrothieno[2,3-b]pyridine-5-carboxylate

CAS Number:

869493-47-0

Molecular Formula:

C12H13NO4S

Molecular Weight:

267.3009

IUPAC Name:

methyl 4-hydroxy-6-oxo-7-propan-2-ylthieno[2,3-b]pyridine-5-carboxylate

InChI:

InChI=1S/C12H13NO4S/c1-6(2)13-10(15)8(12(16)17-3)9(14)7-4-5-18-11(7)13/h4-6,14H,1-3H3

InChI Key:

KYLVAAZIXFBMFN-UHFFFAOYSA-N

SMILES:

COC(=O)c1c(O)c2ccsc2n(c1=O)C(C)C

Complexity:

418

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

267.057g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

267.299g/mol

Monoisotopic Mass:

267.057g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

95.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3