3-[2-(2-Carboxyethylthio)-6-phenylpyrimidin-4-ylthio]propanoic acid

3-[2-(2-carboxyethylsulfanyl)-6-phenylpyrimidin-4-yl]sulfanylpropanoic acid

Also Known As: ChemDiv2_005054|Oprea1_470825|Oprea1_539358|IDI1_003769|AG-690/15434541|A2467/0104760|3,3'-[(6-phenylpyrimidine-2,4-diyl)disulfanediyl]dipropanoic acid|3-[2-(2-carboxyethylthio)-6-phenylpyrimidin-4-ylthio]propanoic acid|3,3'-((6-phenylpyrimidine-2,4-diyl)bis(sulfanediyl))dipropanoic acid|3-[2-(2-carboxyethylsulfanyl)-6-phenylpyrimidin-4-yl]sulfanylpropanoic acid|3-({2-[(2-carboxyethyl)sulfanyl]-6-phenyl-4-pyrimidinyl}sulfanyl)propanoic acid|3-({2-[(2-CARBOXYETHYL)SULFANYL]-6-PHENYLPYRIMIDIN-4-YL}SULFANYL)PROPANOIC ACID

Molecular Formula	C16H16N2O4S2
Molecular Weight	364.05515 g/mol
LogP	3.2772
Topological Polar Surface Area	100.38 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	9
Exact Mass	364.05515
Monoisotopic Mass	364.05515
Heavy Atoms	24
Complexity	672.2285

Chemical Identifiers

CAS Number	347341-62-2
SMILES	C1=CC=C(C=C1)C2=CC(=NC(=N2)SCCC(=O)O)SCCC(=O)O