 Home > Encyclopedia > 7-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-11-methyl-2,6-dioxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile

7-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-11-methyl-2,6-dioxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile

7-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-11-methyl-2,6-dioxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile structure

CAS No:
890014-93-4
Formula:
C22H13FN6O2S2
Chemical Name:
7-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-11-methyl-2,6-dioxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile
Synonyms:
CHEMBL1558965;HMS1842P04;ZINC2358596;CCG-73553;STK820498;AKOS001512876;MCULE-5086459395;NCGC00114668-01;ST50123196;D021-0014;1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-10-methyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile;1-{5-[(4-fluorobenzyl)thio]-1,3,4-thiadiazol-2-yl}-10-methyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile;1-{5-[(4-fluorophenyl)methylthio](1,3,4-thiadiazol-2-yl)}-10-methyl-2,5-dioxo- 1,6-dihydropyridino[2,3-d]pyridino[1,2-a]pyrimidine-3-carbonitrile;890014-93-4

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7-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-11-methyl-2,6-dioxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile Basic Attributes

Molecular Weight：

476.5 g/mol

Exact Mass：

476.05254419 g/mol

Characteristics

PSA：

156 Å²

Computed Properties

Molecular Weight:476.5
XLogP3:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:476.05254419
Monoisotopic Mass:476.05254419
Topological Polar Surface Area:156
Heavy Atom Count:33
Complexity:1100
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-[5-[(4-fluorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-11-methyl-2,6-dioxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile

Basic Attributes
Characteristics
Computed Properties

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