Chemical Properties of Mequitazine M (hydroxy-ring), acetylated

Mequitazine M (hydroxy-ring), acetylated

InChI
InChI=1S/C22H24N2O2S/c1-15(25)26-18-6-7-20-22(12-18)27-21-5-3-2-4-19(21)24(20)14-17-13-23-10-8-16(17)9-11-23/h2-7,12,16-17H,8-11,13-14H2,1H3
InChI Key
PVFNARVJNNWVFE-UHFFFAOYSA-N
Formula
C22H24N2O2S
SMILES
CC(=O)Oc1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2
Molecular Weight1
380.50
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ω 0.7716 Relay (1.0) Calculated Property
ΔfG° 159.73 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas -151.19 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 134.73 kJ/mol Relay (1.0) Calculated Property
IE 6.71 eV Relay (1.0) Calculated Property
log10WS -4.79 Relay (1.0) Calculated Property
logPoct/wat 4.556 Crippen Calculated Property
McVol 284.490 ml/mol McGowan Calculated Property
Pc 1420.06 kPa Relay (1.0-beta) Calculated Property
Inp 2550.00 NIST
Tboil 765.28 K Relay (1.0) Calculated Property
Tc 1073.89 K Relay (1.0) Calculated Property
Tfus 459.38 K Relay (1.0) Calculated Property
Vc 1.021 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Pecazine M (HO-), monoacetylated. Mequitazine M (hydroxy-sulfoxide), acetylated. Pecazine M (nor-HO-), diacetylated. Mequitazine. Mequitazine M (sulfoxide). Perazine M (HO-), monoacetylated. Mequitazine M (sulfone). Mepazine. Pecazine M (nor-), monoacetylated. Alimemazine M (nor-HO-), diacetylated. Methdilazine. Levomepromazine M (nor-HO-), diacetylated. (E)-Methyl 2-((1'R,6'R,7'S,8a'S)-6'-ethyl-2-oxo-3',5',6',7',8',8a'-hexahydro-2'H-spiro[indoline-3,1'-indolizin]-7'-yl)-3-methoxyacrylate. Eburnamenine-14-carboxylic acid, 14,15-dihydro-14-hydroxy-, methyl ester, (3«alpha»,14«alpha»,16«alpha»)-. QUINIDINE, M(HO-), AC.

Find more compounds similar to Mequitazine M (hydroxy-ring), acetylated.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.