Chemical Properties of (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane (CAS 91757-02-7)

(2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane

InChI
InChI=1S/C42H34N4O/c47-42-39(32-21-9-3-10-22-32)44-35-26-14-16-28-37(35)46(42)40(33-23-11-4-12-24-33)41-38(31-19-7-2-8-20-31)43-34-25-13-15-27-36(34)45(41)29-30-17-5-1-6-18-30/h1-28,40-42,47H,29H2
InChI Key
SPVCYXNEMUPGJB-UHFFFAOYSA-N
Formula
C42H34N4O
SMILES
OC1C(c2ccccc2)=Nc2ccccc2N1C(c1ccccc1)C1C(c2ccccc2)=Nc2ccccc2N1Cc1ccccc1
Molecular Weight1
610.75
CAS
91757-02-7
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Physical Properties

Property Value Unit Source
ω 1.0079 Relay (1.0) Calculated Property
ΔfG° 865.03 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 718.23 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 225.11 kJ/mol Relay (1.0) Calculated Property
IE 7.16 eV Relay (1.0) Calculated Property
log10WS -7.16 Relay (1.0) Calculated Property
logPoct/wat 8.897 Crippen Calculated Property
McVol 475.550 ml/mol McGowan Calculated Property
Pc 490.27 kPa Relay (1.0-beta) Calculated Property
Tboil 925.36 K Relay (1.0) Calculated Property
Tc 1485.80 K Relay (1.0) Calculated Property
Tfus 458.22 K Relay (1.0) Calculated Property
Vc 1.668 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Nalmefene. Strychnine. 3-O,6-O,N-Triacetylnormorphine. acetylepibaptifoline. Brucine. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Benzylmorphine. Guanosine, N-trimethylsilyl-, 2',3',5'-tris(trimethylsilyl) ether. Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, acetate (ester), (5«alpha»,6«alpha»)-. TCN. Ergotamine. Triazolo[4,5-d]pyrimidin-7-ol,3h-v-, 5-amino-3-(2',3'-o-isopropylidene-beta-d-ribofuranosyl)-, 5'-diphenyl phosphate (keto form). Dihydroergokryptine. Nicocodine. Nicodicodine.

Find more compounds similar to (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane.

Sources

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