578001-81-7
4-[([[4-(4-CHLOROPHENYL)-5-(4-METHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETYL)AMINO]BENZOIC ACID
Name
4-[([[4-(4-CHLOROPHENYL)-5-(4-METHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETYL)AMINO]BENZOIC ACID
Formula
C24 H19 Cl N4 O4 S
MolWeight
494.957
1Identification
【Name】
4-[([[4-(4-CHLOROPHENYL)-5-(4-METHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETYL)AMINO]BENZOIC ACID
【CAS】
【MDL】
MFCD03473626
【English Synonyms】
【Formula】
C24 H19 Cl N4 O4 S
【MolWeight】
494.957
【Inchi】
InChI=1S/C24H19ClN4O4S/c1-33-20-12-4-15(5-13-20)22-27-28-24(29(22)19-10-6-17(25)7-11-19)34-14-21(30)26-18-8-2-16(3-9-18)23(31)32/h2-13H,14H2,1H3,(H,26,30)(H,31,32)
【InChIKey】
InChIKey=QVGANIUHCQZWEG-UHFFFAOYSA-N
【SMILES】
COc1ccc(cc1)c2nnc(n2c3ccc(cc3)Cl)SCC(=O)Nc4ccc(cc4)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[([[4-(4-CHLOROPHENYL)-5-(4-METHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL]ACETYL)AMINO]BENZOIC ACID.cml
Quick Release
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Sigma-Aldrich Corporation
Catalog No:L415928-1EA 10MG
Country/Region:United States
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Catalog No:L415928-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 578001-81-7 Suppliers>>