585562-55-6
ACETAMIDE, N-(2-METHOXY-3-DIBENZOFURANYL)-2-[[1-(4-METHYLPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL]THIO]-
Name
ACETAMIDE, N-(2-METHOXY-3-DIBENZOFURANYL)-2-[[1-(4-METHYLPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL]THIO]-
Formula
C27 H21 N5 O3 S
MolWeight
495.561
1Identification
【Name】
ACETAMIDE, N-(2-METHOXY-3-DIBENZOFURANYL)-2-[[1-(4-METHYLPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL]THIO]-
【CAS】
【MDL】
MFCD04030753
【English Synonyms】
【Formula】
C27 H21 N5 O3 S
【MolWeight】
495.561
【Inchi】
InChI=1S/C27H21N5O3S/c1-16-7-9-17(10-8-16)32-26-20(13-30-32)27(29-15-28-26)36-14-25(33)31-21-12-23-19(11-24(21)34-2)18-5-3-4-6-22(18)35-23/h3-13,15H,14H2,1-2H3,(H,31,33)
【InChIKey】
InChIKey=ICJDOXWZKFTYIB-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)n2c3c(cn2)c(ncn3)SCC(=O)Nc4cc5c(cc4OC)c6ccccc6o5
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ACETAMIDE, N-(2-METHOXY-3-DIBENZOFURANYL)-2-[[1-(4-METHYLPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-YL]THIO]-.cml
Quick Release
1-(4-METHYLPHENYL)PYRIDO[3,2-E]-2-THIOURACIL
89374-57-2
4-HYDROXY-1-PHENYLPYRAZOLO[3,4-D]PYRIMIDINE
21314-17-0
4,5,6,7-TETRAHYDRO-1-PHENYL-1H-PYRAZOLO[4,3-C]PYRIDINE
396133-34-9
4-AMINO-1-PHENYLPYRAZOLO[3,4-D]PYRIMIDINE
5334-30-5
PIRODOMAST
108310-20-9
1-PHENYL-1H-PYRIDO[2,3-D][1,3]OXAZINE-2,4-DIONE
138305-19-8
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Catalog No:585562-55-6 up to kgs
Country/Region:United States
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Catalog No:ATM585562556 up to kgs
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