Chemical Properties of Imidazole-4-carboxamide, 1-benzyl-5-(benzylamino)- (CAS 7026-48-4)

Imidazole-4-carboxamide, 1-benzyl-5-(benzylamino)-

InChI
InChI=1S/C18H18N4O/c19-17(23)16-18(20-11-14-7-3-1-4-8-14)22(13-21-16)12-15-9-5-2-6-10-15/h1-10,13,20H,11-12H2,(H2,19,23)
InChI Key
IKOPTFPVYMQQLP-UHFFFAOYSA-N
Formula
C18H18N4O
SMILES
NC(=O)c1ncn(Cc2ccccc2)c1NCc1ccccc1
Molecular Weight1
306.36
CAS
7026-48-4
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Physical Properties

Property Value Unit Source
ω 0.8384 Relay (1.0) Calculated Property
ΔfG° 453.00 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 168.20 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 122.99 kJ/mol Relay (1.0) Calculated Property
IE 7.81 eV Relay (1.0) Calculated Property
log10WS -4.38 Relay (1.0) Calculated Property
logPoct/wat 2.642 Crippen Calculated Property
McVol 238.990 ml/mol McGowan Calculated Property
Pc 2687.90 kPa Relay (1.0-beta) Calculated Property
Tboil 703.29 K Relay (1.0) Calculated Property
Tc 1075.48 K Relay (1.0) Calculated Property
Tfus 443.24 K Relay (1.0) Calculated Property
Vc 0.862 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

Imidazole-4-carboxamide, 1-benzyl-5-(n-benzylformamido)-. risperidone. azadirachtin. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. 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 Imidazole-4-carboxamide, 1-benzyl-5-(benzylamino)-.

Sources

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