796083-83-5
[(4-([(2,4-DIMETHYLPHENYL)SULFONYL]AMINO)BENZOYL)AMINO]ACETIC ACID
Name[(4-([(2,4-DIMETHYLPHENYL)SULFONYL]AMINO)BENZOYL)AMINO]ACETIC ACID
1Identification
【Name】
[(4-([(2,4-DIMETHYLPHENYL)SULFONYL]AMINO)BENZOYL)AMINO]ACETIC ACID
【CAS】
【MDL】
MFCD06371692
【English Synonyms】
【Formula】
C17 H18 N2 O5 S
【MolWeight】
362.404
【Inchi】
InChI=1S/C17H18N2O5S/c1-11-3-8-15(12(2)9-11)25(23,24)19-14-6-4-13(5-7-14)17(22)18-10-16(20)21/h3-9,19H,10H2,1-2H3,(H,18,22)(H,20,21)
【InChIKey】
InChIKey=BQLVEKZXBMGZFD-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c(c1)C)S(=O)(=O)Nc2ccc(cc2)C(=O)NCC(=O)O
【MOL File】
[(4-([(2,4-DIMETHYLP….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
[(4-([(2,4-DIMETHYLPHENYL)SULFONYL]AMINO)BENZOYL)AMINO]ACETIC ACID.cml