Chemical Properties of Daniquidone (CAS 67199-66-0)

Daniquidone

InChI
InChI=1S/C15H11N3O/c16-10-5-6-13-9(7-10)8-18-14(17-13)11-3-1-2-4-12(11)15(18)19/h1-7H,8,16H2
InChI Key
SRIOCKJKFXAKHK-UHFFFAOYSA-N
Formula
C15H11N3O
SMILES
Nc1ccc2c(c1)CN1C(=O)c3ccccc3C1=N2
Molecular Weight1
249.27
CAS
67199-66-0
Other Names
  • Isoindolo(1,2-b)quinazolin-12(10H)-one, 8-amino-
  • 8-Aminoisoindolo[1,2-b]quinazolin-12(10H)-one
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Physical Properties

Property Value Unit Source
ω 0.7174 Relay (1.0) Calculated Property
ΔfG° 252.87 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 195.26 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 106.49 kJ/mol Relay (1.0) Calculated Property
IE 7.39 eV Relay (1.0) Calculated Property
log10WS -3.64 Relay (1.0) Calculated Property
logPoct/wat 2.317 Crippen Calculated Property
McVol 180.180 ml/mol McGowan Calculated Property
Pc 3139.24 kPa Relay (1.0-beta) Calculated Property
Tboil 705.22 K Relay (1.0) Calculated Property
Tc 1077.18 K Relay (1.0) Calculated Property
Tfus 505.68 K Relay (1.0) Calculated Property
Vc 0.676 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Tazettine. 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 Daniquidone.

Sources

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