Name: Name:methyl 3-amino-6-[(2-methoxy-2-oxoethyl)sulfanyl]thieno[3,2-b]pyridine-2-carboxylate
Brand: Angene
SKU: AG01BD4G
Rating: 90 (10 reviews)

methyl 3-amino-6-[(2-methoxy-2-oxoethyl)sulfanyl]thieno[3,2-b]pyridine-2-carboxylate

CAS No.:

1803606-73-6

Catalog Number:

AG01BD4G

Molecular Formula:

C12H12N2O4S2

Molecular Weight:

312.3647

Catalog Number:

AG01BD4G

Chemical Name:

methyl 3-amino-6-[(2-methoxy-2-oxoethyl)sulfanyl]thieno[3,2-b]pyridine-2-carboxylate

CAS Number:

1803606-73-6

Molecular Formula:

C12H12N2O4S2

Molecular Weight:

312.3647

MDL Number:

MFCD28023762

IUPAC Name:

methyl 3-amino-6-(2-methoxy-2-oxoethyl)sulfanylthieno[3,2-b]pyridine-2-carboxylate

InChI:

InChI=1S/C12H12N2O4S2/c1-17-8(15)5-19-6-3-7-10(14-4-6)9(13)11(20-7)12(16)18-2/h3-4H,5,13H2,1-2H3

InChI Key:

SWXPXCLOQIJBBN-UHFFFAOYSA-N

SMILES:

COC(=O)CSc1cnc2c(c1)sc(c2N)C(=O)OC

Complexity:

383

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

312.024g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

312.358g/mol

Monoisotopic Mass:

312.024g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

145A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4