Chemical Properties of 4-(ethylamino)-2-(3-methoxypropyl)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide

4-(ethylamino)-2-(3-methoxypropyl)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide

InChI
InChI=1S/C12H21N3O5S3/c1-3-14-10-8-15(5-4-6-20-2)23(18,19)12-9(10)7-11(21-12)22(13,16)17/h7,10,14H,3-6,8H2,1-2H3,(H2,13,16,17)
InChI Key
HCRKCZRJWPKOAR-UHFFFAOYSA-N
Formula
C12H21N3O5S3
SMILES
CCNC1CN(CCCOC)S(=O)(=O)c2sc(S(N)(=O)=O)cc21
Molecular Weight1
383.52
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Physical Properties

Property Value Unit Source
ω 0.8771 Relay (1.0) Calculated Property
ΔfG° -224.32 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -680.18 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 114.45 kJ/mol Relay (1.0) Calculated Property
IE 8.50 eV Relay (1.0) Calculated Property
log10WS -2.95 Rytting (2005)
logPoct/wat 0.087 Crippen Calculated Property
McVol 257.960 ml/mol McGowan Calculated Property
Pc 1644.66 kPa Relay (1.0-beta) Calculated Property
Tboil 722.31 K Relay (1.0) Calculated Property
Tc 996.80 K Relay (1.0) Calculated Property
Tfus 401.37 K Relay (1.0) Calculated Property
Vc 0.893 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Nalmefene. Strychnine. 3-O,6-O,N-Triacetylnormorphine. Benzylmorphine. Nicocodine. Buprenorphine. Dihydroergokryptine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Deserpidine. Paclitaxel. Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'«alpha»,10«alpha»)-. Ergotamine.

Find more compounds similar to 4-(ethylamino)-2-(3-methoxypropyl)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide.

Sources

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