Chemical Properties of Olanzapine AC

Olanzapine AC

InChI
InChI=1S/C19H22N4OS/c1-13-12-15-18(22-10-8-21(3)9-11-22)20-16-6-4-5-7-17(16)23(14(2)24)19(15)25-13/h4-7,12H,8-11H2,1-3H3
InChI Key
ACCNIDYFTWFBGF-UHFFFAOYSA-N
Formula
C19H22N4OS
SMILES
CC(=O)N1c2ccccc2N=C(N2CCN(C)CC2)c2cc(C)sc21
Molecular Weight1
354.47
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Physical Properties

Property Value Unit Source
ω 0.7741 Relay (1.0) Calculated Property
ΔfG° 360.59 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 142.98 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 111.05 kJ/mol Relay (1.0) Calculated Property
IE 7.50 eV Relay (1.0) Calculated Property
log10WS -3.08 Relay (1.0) Calculated Property
logPoct/wat 3.380 Crippen Calculated Property
McVol 267.170 ml/mol McGowan Calculated Property
Pc 1833.67 kPa Relay (1.0-beta) Calculated Property
Inp 2780.00 NIST
Tboil 715.40 K Relay (1.0) Calculated Property
Tc 1047.62 K Relay (1.0) Calculated Property
Tfus 458.92 K Relay (1.0) Calculated Property
Vc 0.955 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Olanzapine-M (nor-) 2AC. ethyl eburnamenine-14-carboxylate. 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 Olanzapine AC.

Sources

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