746607-41-0
([4-(2-FLUOROPHENYL)-5-(3,4,5-TRIMETHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID
Name
([4-(2-FLUOROPHENYL)-5-(3,4,5-TRIMETHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID
Formula
C19 H18 F N3 O5 S
MolWeight
419.431
1Identification
【Name】
([4-(2-FLUOROPHENYL)-5-(3,4,5-TRIMETHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID
【CAS】
【MDL】
MFCD05273441
【English Synonyms】
【Formula】
C19 H18 F N3 O5 S
【MolWeight】
419.431
【Inchi】
InChI=1S/C19H18FN3O5S/c1-26-14-8-11(9-15(27-2)17(14)28-3)18-21-22-19(29-10-16(24)25)23(18)13-7-5-4-6-12(13)20/h4-9H,10H2,1-3H3,(H,24,25)
【InChIKey】
InChIKey=NAKTVGRCBGRKHC-UHFFFAOYSA-N
【SMILES】
COc1cc(cc(c1OC)OC)c2nnc(n2c3ccccc3F)SCC(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
([4-(2-FLUOROPHENYL)-5-(3,4,5-TRIMETHOXYPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID.cml
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Catalog No:EN300-09510 50G
Catalog No:EN300-09510 5G
Catalog No:EN300-09510 25G
Catalog No:EN300-09510 250MG
Catalog No:EN300-09510 10G
Catalog No:EN300-09510 500MG
Catalog No:EN300-09510 1G
Catalog No:EN300-09510 2.5G
Country/Region:Ukraine
Business Type:Trading Company
http://www.enamine.net
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