Chemical Properties of 1-Phenylcarbamoyl-2,3-phthaloylpyrrocoline (CAS 3135-54-4)

1-Phenylcarbamoyl-2,3-phthaloylpyrrocoline

InChI
InChI=1S/C23H14N2O3/c26-21-15-10-4-5-11-16(15)22(27)20-19(21)18(17-12-6-7-13-25(17)20)23(28)24-14-8-2-1-3-9-14/h1-13H,(H,24,28)
InChI Key
UQCAZSLFSDIWBA-UHFFFAOYSA-N
Formula
C23H14N2O3
SMILES
O=C1c2ccccc2C(=O)c2c1c(C(=O)Nc1ccccc1)c1ccccn21
Molecular Weight1
366.37
CAS
3135-54-4
Other Names
  • 6,11-dihydro-6,11-dioxo-N-phenylbenzo[f]pyrido[1,2-a]indole-12-carboxamide
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Physical Properties

Property Value Unit Source
ω 0.9029 Relay (1.0) Calculated Property
ΔfG° 120.73 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 2.29 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 135.94 kJ/mol Relay (1.0) Calculated Property
IE 7.75 eV Relay (1.0) Calculated Property
log10WS -5.69 Relay (1.0) Calculated Property
logPoct/wat 3.967 Crippen Calculated Property
McVol 262.300 ml/mol McGowan Calculated Property
Pc 2199.64 kPa Relay (1.0-beta) Calculated Property
Tboil 775.87 K Relay (1.0) Calculated Property
Tc 1258.46 K Relay (1.0) Calculated Property
Tfus 531.88 K Relay (1.0) Calculated Property
Vc 0.976 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

1-Phenylcarbamoyl-7-styryl-2,3-phthaloylpyrrocoline. 1-Phenylcarbamoyl-2,3-phthaloyl-7,8-benzopyrrocoline. 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 1-Phenylcarbamoyl-2,3-phthaloylpyrrocoline.

Sources

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