538337-11-0
2-([4-BENZYL-5-[(4-BROMOPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(4-PHENOXYPHENYL)ACETAMIDE
Name
2-([4-BENZYL-5-[(4-BROMOPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(4-PHENOXYPHENYL)ACETAMIDE
Formula
C30 H25 Br N4 O3 S
MolWeight
601.523
1Identification
【Name】
2-([4-BENZYL-5-[(4-BROMOPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(4-PHENOXYPHENYL)ACETAMIDE
【CAS】
【MDL】
MFCD05154827
【English Synonyms】
2-([4-BENZYL-5-[(4-BROMOPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(4-PHENOXYPHENYL)ACETAMIDE
【Formula】
C30 H25 Br N4 O3 S
【MolWeight】
601.523
【Inchi】
InChI=1S/C30H25BrN4O3S/c31-23-11-15-25(16-12-23)37-20-28-33-34-30(35(28)19-22-7-3-1-4-8-22)39-21-29(36)32-24-13-17-27(18-14-24)38-26-9-5-2-6-10-26/h1-18H,19-21H2,(H,32,36)
【InChIKey】
InChIKey=JPESICLSWAXZLZ-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)Cn2c(nnc2SCC(=O)Nc3ccc(cc3)Oc4ccccc4)COc5ccc(cc5)Br
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-([4-BENZYL-5-[(4-BROMOPHENOXY)METHYL]-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)-N-(4-PHENOXYPHENYL)ACETAMIDE.cml
Quick Release
TOP Suppliers
Sigma-Aldrich Corporation
Catalog No:L442712-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 538337-11-0 Suppliers>>
Catalog No:L442712-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 538337-11-0 Suppliers>>