Chemical Properties of RTI 16

RTI 16

InChI
InChI=1S/C14H14N4S/c1-3-18-12-10(6-4-8-15-12)14(19)17(2)11-7-5-9-16-13(11)18/h4-9H,3H2,1-2H3
InChI Key
YNARWAUTTJJADX-UHFFFAOYSA-N
Formula
C14H14N4S
SMILES
CCN1c2ncccc2C(=S)N(C)c2cccnc21
Molecular Weight1
270.36
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Physical Properties

Property Value Unit Source
ω 0.6330 Relay (1.0) Calculated Property
ΔfG° 398.43 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 296.91 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 109.82 kJ/mol Relay (1.0) Calculated Property
IE 7.31 eV Relay (1.0) Calculated Property
log10WS [-4.63; -4.63]   Show Hide
log10WS -4.63 Aq. Solubility Prediction
log10WS -4.63 Estimated Solubility
logPoct/wat 2.760 Crippen Calculated Property
McVol 201.710 ml/mol McGowan Calculated Property
Pc 3013.00 kPa Relay (1.0-beta) Calculated Property
Tboil 679.11 K Relay (1.0) Calculated Property
Tc 1021.27 K Relay (1.0) Calculated Property
Tfus 441.76 K Relay (1.0) Calculated Property
Vc 0.719 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

RTI 17. Reverse Transcriptase inhibitor 1. RTI 2. RTI 12. 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 16.

Sources

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