Name: Name:2-{[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]amino}acetic acid
Brand: Angene
SKU: AG01AIIE
Rating: 90 (10 reviews)

2-{[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]amino}acetic acid

CAS No.:

1082187-03-8

Catalog Number:

AG01AIIE

Molecular Formula:

C14H10FN3O2S

Molecular Weight:

303.3115

Catalog Number:

AG01AIIE

Chemical Name:

2-{[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]amino}acetic acid

CAS Number:

1082187-03-8

Molecular Formula:

C14H10FN3O2S

Molecular Weight:

303.3115

MDL Number:

MFCD11561679

IUPAC Name:

2-[[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]amino]acetic acid

InChI:

InChI=1S/C14H10FN3O2S/c15-9-3-1-8(2-4-9)10-6-21-14-12(10)13(17-7-18-14)16-5-11(19)20/h1-4,6-7H,5H2,(H,19,20)(H,16,17,18)

InChI Key:

NXBDWKKFBANLRV-UHFFFAOYSA-N

SMILES:

OC(=O)CNc1ncnc2c1c(cs2)c1ccc(cc1)F

Complexity:

379

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

303.048g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

303.311g/mol

Monoisotopic Mass:

303.048g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

103A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2