735322-09-5
3-(5-DIETHYLSULFAMOYL-1-ETHYL-1H-BENZOIMIDAZOL-2-YL)-PROPIONIC ACID
Name3-(5-DIETHYLSULFAMOYL-1-ETHYL-1H-BENZOIMIDAZOL-2-YL)-PROPIONIC ACID
1Identification
【Name】
3-(5-DIETHYLSULFAMOYL-1-ETHYL-1H-BENZOIMIDAZOL-2-YL)-PROPIONIC ACID
【CAS】
【MDL】
MFCD04614619
【English Synonyms】
【Formula】
C16 H23 N3 O4 S
【MolWeight】
353.441
【Inchi】
InChI=1S/C16H23N3O4S/c1-4-18(5-2)24(22,23)12-7-8-14-13(11-12)17-15(19(14)6-3)9-10-16(20)21/h7-8,11H,4-6,9-10H2,1-3H3,(H,20,21)
【InChIKey】
InChIKey=ZFXCTCCKWQDCIC-UHFFFAOYSA-N
【SMILES】
CCn1c2ccc(cc2nc1CCC(=O)O)S(=O)(=O)N(CC)CC
【MOL File】
3-(5-DIETHYLSULFAMOY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-(5-DIETHYLSULFAMOYL-1-ETHYL-1H-BENZOIMIDAZOL-2-YL)-PROPIONIC ACID.cml