-
Name
N-(1-Allyl-2-pyrrolidinyl)methyl-2,3-dimethoxy-5-sulfamoylbenzamide
- EINECS 266-435-5
- CAS No. 66644-81-3
- Article Data1
- CAS DataBase
- Density 1.23 g/cm3
- Solubility
- Melting Point 128 °C
- Formula C17H25N3O5S
- Boiling Point
- Molecular Weight 383.469
- Flash Point
- Transport Information
- Appearance
- Safety
- Risk Codes
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Molecular Structure
- Hazard Symbols
- Synonyms Benzamide,5-(aminosulfonyl)-2,3-dimethoxy-N-[[1-(2-propenyl)-2-pyrrolidinyl]methyl]-(9CI);(?à)-Veralipride;Agreal;LIR 1660;Veralipride;
- PSA 119.34000
- LogP 2.84130
Veralipride Specification
The cas register number of Veralipride is 66644-81-3. It also can be called as N-(1-Allyl-2-pyrrolidinyl)methyl-2,3-dimethoxy-5-sulfamoylbenzamide and the Systematic name about this chemical is 2,3-dimethoxy-N-[(1-prop-2-enylpyrrolidin-2-yl)methyl]-5-sulfamoylbenzamide. Classification Code about this chemical are Antipsychotic Agents, Central Nervous System Agents, Central Nervous System Depressants, Dopamine antagonist, Psychotropic Drugs and Tranquilizing Agents. This chemical can be used in treatment of menopausal disorders.
Physical properties about Veralipride are: (1)ACD/LogP: 0.49; (2)ACD/LogD (pH 5.5): -2.22; (3)ACD/LogD (pH 7.4): -0.58; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 3.76; (8)#H bond acceptors: 8; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 8; (11)Polar Surface Area: 87.77Å2; (12)Index of Refraction: 1.547; (13)Molar Refractivity: 98.94 cm3; (14)Molar Volume: 311.7 cm3; (15)Polarizability: 39.22x10-24cm3; (16)Surface Tension: 44.8 dyne/cm.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(N)c1cc(c(OC)c(OC)c1)C(=O)NCC2N(C\C=C)CCC2
(2)InChI: InChI=1/C17H25N3O5S/c1-4-7-20-8-5-6-12(20)11-19-17(21)14-9-13(26(18,22)23)10-15(24-2)16(14)25-3/h4,9-10,12H,1,5-8,11H2,2-3H3,(H,19,21)(H2,18,22,23)
(3)InChIKey: RYJXBGGBZJGVQF-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C17H25N3O5S/c1-4-7-20-8-5-6-12(20)11-19-17(21)14-9-13(26(18,22)23)10-15(24-2)16(14)25-3/h4,9-10,12H,1,5-8,11H2,2-3H3,(H,19,21)(H2,18,22,23)
(5)Std. InChIKey: RYJXBGGBZJGVQF-UHFFFAOYSA-N
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