Name: Name:1-{thieno[2,3-d]pyrimidin-4-yl}pyrrolidine-2-carboxylic acid
Brand: Angene
SKU: AG01DUBN
Rating: 90 (10 reviews)

1-{thieno[2,3-d]pyrimidin-4-yl}pyrrolidine-2-carboxylic acid

CAS No.:

1028366-39-3

Catalog Number:

AG01DUBN

Molecular Formula:

C11H11N3O2S

Molecular Weight:

249.2889

Catalog Number:

AG01DUBN

Chemical Name:

1-{thieno[2,3-d]pyrimidin-4-yl}pyrrolidine-2-carboxylic acid

CAS Number:

1028366-39-3

Molecular Formula:

C11H11N3O2S

Molecular Weight:

249.2889

MDL Number:

MFCD08445187

IUPAC Name:

1-thieno[2,3-d]pyrimidin-4-ylpyrrolidine-2-carboxylic acid

InChI:

InChI=1S/C11H11N3O2S/c15-11(16)8-2-1-4-14(8)9-7-3-5-17-10(7)13-6-12-9/h3,5-6,8H,1-2,4H2,(H,15,16)

InChI Key:

SNQHAQGRGDHJFK-UHFFFAOYSA-N

SMILES:

OC(=O)C1CCCN1c1ncnc2c1ccs2

Complexity:

315

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

249.057g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

249.288g/mol

Monoisotopic Mass:

249.057g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

94.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1