Chemical Properties of Dosulepin-M (nor-HO-) 2AC

Dosulepin-M (nor-HO-) 2AC

InChI
InChI=1S/C22H23NO3S/c1-15(24)23(3)12-6-9-20-19-8-5-4-7-17(19)14-27-22-11-10-18(13-21(20)22)26-16(2)25/h4-5,7-11,13H,6,12,14H2,1-3H3/b20-9-
InChI Key
KBHVNXXCVAKZIQ-UKWGHVSLSA-N
Formula
C22H23NO3S
SMILES
CC(=O)Oc1ccc2c(c1)C(=CCCN(C)C(C)=O)c1ccccc1CS2
Molecular Weight1
381.49
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Physical Properties

Property Value Unit Source
ΔfusH° 49.68 kJ/mol Joback Calculated Property
logPoct/wat 4.518 Crippen Calculated Property
McVol 293.500 ml/mol McGowan Calculated Property
Inp 3150.00 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, Log10 of Water solubility in mol/l 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [895.79; 965.77] J/mol×K [961.67; 1202.78] Show Hide
Cp,gas 895.79 J/mol×K 961.67 Joback Calculated Property
Cp,gas 909.35 J/mol×K 1001.85 Joback Calculated Property
Cp,gas 921.97 J/mol×K 1042.04 Joback Calculated Property
Cp,gas 933.79 J/mol×K 1082.22 Joback Calculated Property
Cp,gas 944.95 J/mol×K 1122.41 Joback Calculated Property
Cp,gas 955.56 J/mol×K 1162.59 Joback Calculated Property
Cp,gas 965.77 J/mol×K 1202.78 Joback Calculated Property

Similar Compounds

Dosulepin-M (HO-) isomer-2 AC. Dosulepin-M (HO-) isomer-1 AC. Dosulepin-M (nor-) AC. narwedine. 6H-Benzofuro[3a,3,2-ef][2]benzazepin-6-one, 4a,5,9,10,11,12-hexahydro-3-methoxy-11-methyl-, (4aS,8aS)-. Bicyclohexyl-1,1'-diol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Moexipril desethyl 3Me (Moexprilate 3Me). Moexipril Me. Moexipril desethyl - H2O Me (Moexprilate - H2O Me). Quinapril desethyl 3Me (Quinaprilate 3Me). Aflatoxin G1. 9H-purine-6(1h)-thione, 2-amino-9-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. Ajmaline. Ergocristine. (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate.

Find more compounds similar to Dosulepin-M (nor-HO-) 2AC.

Sources

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