587012-55-3
N-(2,6-DIBROMO-4-METHYLPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE
Name
N-(2,6-DIBROMO-4-METHYLPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE
Formula
C21 H21 Br2 N3 O2 S2
MolWeight
571.356
1Identification
【Name】
N-(2,6-DIBROMO-4-METHYLPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE
【CAS】
【MDL】
MFCD04034274
【English Synonyms】
【Formula】
C21 H21 Br2 N3 O2 S2
【MolWeight】
571.356
【Inchi】
InChI=1S/C21H21Br2N3O2S2/c1-3-26-20(28)17-12-6-4-5-7-15(12)30-19(17)25-21(26)29-10-16(27)24-18-13(22)8-11(2)9-14(18)23/h8-9H,3-7,10H2,1-2H3,(H,24,27)
【InChIKey】
InChIKey=IXOBKKURGGZHGO-UHFFFAOYSA-N
【SMILES】
CCn1c(=O)c2c3c(sc2nc1SCC(=O)Nc4c(cc(cc4Br)C)Br)CCCC3
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(2,6-DIBROMO-4-METHYLPHENYL)-2-[(3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-2-YL)SULFANYL]ACETAMIDE.cml
Quick Release
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Sigma-Aldrich Corporation
Catalog No:L413607-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
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Catalog No:L413607-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 587012-55-3 Suppliers>>