Chemical Properties of RTI 5

RTI 5

InChI
InChI=1S/C15H15N3O/c1-3-18-13-9-5-4-8-12(13)17(2)15(19)11-7-6-10-16-14(11)18/h4-10H,3H2,1-2H3
InChI Key
QIBWCUCLHZVYNL-UHFFFAOYSA-N
Formula
C15H15N3O
SMILES
CCN1c2ccccc2N(C)C(=O)c2cccnc21
Molecular Weight1
253.31
Other Names
  • 11-ethyl-6-methylpyrido[3,2-c][1,5]benzodiazepin-5-one
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Physical Properties

Property Value Unit Source
ω 0.6675 Relay (1.0) Calculated Property
ΔfG° 276.50 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 56.81 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 97.56 kJ/mol Relay (1.0) Calculated Property
IE 7.56 eV Relay (1.0) Calculated Property
log10WS [-3.32; -3.32]   Show Hide
log10WS -3.32 Aq. Solubility Prediction
log10WS -3.32 Estimated Solubility
logPoct/wat 2.830 Crippen Calculated Property
McVol 195.340 ml/mol McGowan Calculated Property
Pc 2726.03 kPa Relay (1.0-beta) Calculated Property
Tboil 671.16 K Relay (1.0) Calculated Property
Tc 990.54 K Relay (1.0) Calculated Property
Tfus 423.48 K Relay (1.0) Calculated Property
Vc 0.720 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

RTI 17. RTI 23. 5,6-Dihydrouracil riboside, TMS. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. Ergotaman-3',6',18-trione, 12'-hydroxy-2'-(1-methylethyl)-5'-(2-methylpropyl)-, (5'«alpha»)-. AJMALINE, M(DIHYDRO-), AC. 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 RTI 5.

Sources

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