Chemical Properties of RTI 12

RTI 12

InChI
InChI=1S/C14H13ClN4O/c1-3-19-12-9(5-4-8-16-12)14(20)18(2)10-6-7-11(15)17-13(10)19/h4-8H,3H2,1-2H3
InChI Key
YSEMEGXOKULCML-UHFFFAOYSA-N
Formula
C14H13ClN4O
SMILES
CCN1c2ncccc2C(=O)N(C)c2ccc(Cl)nc21
Molecular Weight1
288.74
Other Names
  • 133627-12-0
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Physical Properties

Property Value Unit Source
ω 0.6933 Relay (1.0) Calculated Property
ΔfG° 283.07 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 34.42 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 101.90 kJ/mol Relay (1.0) Calculated Property
IE 7.91 eV Relay (1.0) Calculated Property
log10WS [-4.11; -4.11]   Show Hide
log10WS -4.11 Aq. Solubility Prediction
log10WS -4.11 Estimated Solubility
logPoct/wat 2.878 Crippen Calculated Property
McVol 203.470 ml/mol McGowan Calculated Property
Pc 2730.59 kPa Relay (1.0-beta) Calculated Property
Tboil 673.26 K Relay (1.0) Calculated Property
Tc 1011.45 K Relay (1.0) Calculated Property
Tfus 472.16 K Relay (1.0) Calculated Property
Vc 0.745 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Reverse Transcriptase inhibitor 1. RTI 2. 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 12.

Sources

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