Chemical Properties of glybuthiazole

glybuthiazole

InChI
InChI=1S/C12H16N4O2S2/c1-12(2,3)10-14-15-11(19-10)16-20(17,18)9-6-4-8(13)5-7-9/h4-7H,13H2,1-3H3,(H,15,16)
InChI Key
DVQVBLBKEXITIK-UHFFFAOYSA-N
Formula
C12H16N4O2S2
SMILES
CC(C)(C)c1nnc(NS(=O)(=O)c2ccc(N)cc2)s1
Molecular Weight1
312.42
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Physical Properties

Property Value Unit Source
ω 0.7775 Relay (1.0) Calculated Property
ΔfG° 211.32 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -93.19 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 121.66 kJ/mol Relay (1.0) Calculated Property
IE 7.78 eV Relay (1.0) Calculated Property
log10WS -3.74 Aq. Solubility Prediction
logPoct/wat 2.219 Crippen Calculated Property
McVol 221.080 ml/mol McGowan Calculated Property
Pc 2300.33 kPa Relay (1.0-beta) Calculated Property
Tboil 678.68 K Relay (1.0) Calculated Property
Tc 1000.36 K Relay (1.0) Calculated Property
Tfus 490.05 K Relay (1.0) Calculated Property
Vc 0.788 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

4-amino-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)benzenesulfonamide. 4-amino-N-(5-ethyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide. sulfamethizole. Pyrazolo[1,5-d][1,2,4]triazin-3-one, 2,6-dimethyl-7,7-tetramethylene. Sulforidazine M (nor-), monoacetylated. 12-O-Methylcarnosol. Cytisine, N-formyl-. 5-Methylcytosine riboside, TMS. «delta»1-tetrahydrocannabinolic acid, n-butyl-boronate. Camoensidine. 1,5-Methano-8H-pyrido[1,2-a][1,5]diazocin-8-one, 3-(3-butenyl)-1,2,3,4,5,6-hexahydro-, (1R)-. N-acetylcytisine. 7,14-Methano-4H,6H-dipyrido[1,2-a:1',2'-E][1,5]diazocin-4-one, 7,7a,8,9,10,11,13,14-octahydro-, [7R-(7«alpha»,7a«alpha»,14«alpha»)]-. Caulophylline. propyl-«delta»1-tetrahydrocannabinolic acid, n-butyl-boronate.

Find more compounds similar to glybuthiazole.

Sources

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