Chemical Properties of Bromopride (CAS 4093-35-0)

Bromopride

InChI
InChI=1S/C14H22BrN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)
InChI Key
GIYAQDDTCWHPPL-UHFFFAOYSA-N
Formula
C14H22BrN3O2
SMILES
CCN(CC)CCNC(=O)c1cc(Br)c(N)cc1OC
Molecular Weight1
344.25
CAS
4093-35-0
Other Names
  • 4-Amino-5-bromo-N-(2-(diethylamino)ethyl)-o-anisamide
  • Artomey
  • Benzamide, 4-amino-5-bromo-N-[2-(diethylamino)ethyl]-2-methoxy-
  • Bromoprida
  • Emepride
  • Emoril
  • VAL 13081
  • Valopride
  • Viadil
  • o-Anisamide, 4-amino-5-bromo-N-[2-(diethylamino)ethyl]-
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Physical Properties

Property Value Unit Source
ΔfusH° 46.28 kJ/mol Joback Calculated Property
log10WS -3.28 Relay (1.0) Calculated Property
logPoct/wat 2.111 Crippen Calculated Property
McVol 239.240 ml/mol McGowan Calculated Property
Inp [2742.00; 2742.00]   Show Hide
Inp 2742.00 NIST
Inp 2742.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [335.25; 741.43] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A3.47940e+01
Coefficient B1.28546e+00
Coefficient C-7.14180e-04
Coefficient D1.35360e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 335.25 J/mol×K 273.00 Calculated Property
Cp,gas 406.17 J/mol×K 353.78 Calculated Property
Cp,gas 469.64 J/mol×K 434.56 Calculated Property
Cp,gas 526.10 J/mol×K 515.33 Calculated Property
Cp,gas 575.96 J/mol×K 596.11 Calculated Property
Cp,gas 619.67 J/mol×K 676.89 Calculated Property
Cp,gas 657.64 J/mol×K 757.67 Calculated Property
Cp,gas 690.30 J/mol×K 838.44 Calculated Property
Cp,gas 718.09 J/mol×K 919.22 Calculated Property
Cp,gas 741.43 J/mol×K 1000.00 Calculated Property

Similar Compounds

Metoclopramide. Tiapride. Mirtazapine-M (nor-HO-) 2AC. Mirtazapine-M (HO-) AC. Mirtazapine-M (nor-HO-methoxy-) 2AC. 5,6-Dihydrouracil riboside, TMS. Hypoxanthine-7-ethanol, 2,3-dihydro-3-(diphenylmethyl)-, acetate. risperidone. Glyceollin III, TMS. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. N-Desmethylmirtazapine. Glyceollin V, TMS. MIRTAZAPINE. Morphine-3-acetate. Hydromorphone, trimethylsilyl ether.

Find more compounds similar to Bromopride.

Sources

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