C22H31N5S3 structure

C22H31N5S3

15-methyl-5-(2-piperidin-1-ylethylsulfanyl)-7-propylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

Also Known As: 11-methyl-3-((2-(piperidin-1-yl)ethyl)thio)-5-(propylthio)-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine|11-methyl-3-{[2-(piperidin-1-yl)ethyl]sulfanyl}-5-(propylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine

CAS: 877779-90-3
Molecular Formula C22H31N5S3
Molecular Weight 461.17416 g/mol
LogP 5.8589
Topological Polar Surface Area 46.32 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 7
Exact Mass 461.17416
Monoisotopic Mass 461.17416
Heavy Atoms 30
Complexity 1021.03723

Chemical Identifiers

CAS Number 877779-90-3
SMILES CCCSC1=NC2=C(C3=C(S2)CCCC3C)C4=NN=C(N41)SCCN5CCCCC5

Product Overview

C22H31N5S3 (CAS 877779-90-3), with molecular formula C22H31N5S3 and molecular weight 461.17416 g/mol. IUPAC: 15-methyl-5-(2-piperidin-1-ylethylsulfanyl)-7-propylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene.

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