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Pravadoline

Pravadoline structure

CAS No:
92623-83-1
Formula:
C23H26N2O3
Chemical Name:
Pravadoline
Synonyms:
Methanone,(4-methoxyphenyl)[2-methyl-1-[2-(4-morpholinyl)ethyl]-1H-indol-3-yl]-;(4-Methoxyphenyl)[2-methyl-1-[2-(4-morpholinyl)ethyl]-1H-indol-3-yl]methanone;Pravadoline;WIN 48098;(4-Methoxyphenyl)(2-methyl-1-(2-morpholinoethyl)-1H-indol-3-yl)methanone;(4-Methoxyphenyl)-[2-methyl-1-(2-morpholin-4-ylethyl)indol-3-yl]methanone
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Pravadoline Basic Attributes

Molecular Weight：

378.472

Exact Mass：

378.46

UNII：

P3JW662TWA

DSSTox ID：

DTXSID2046127

HScode：

2934999090

Characteristics

PSA：

43.7

XLogP3：

3.62

Density：

1.2±0.1 g/cm3

Melting Point：

104-105 °C @ Solvent: Ethyl acetate, Hexane

Boiling Point：

553.1±50.0 °C at 760 mmHg

Flash Point：

288.3±30.1 °C

Refractive Index：

1.603

Collision Cross Section：

193.26 Å² [M+H]+

Drug Information

MeSH Entry Terms：

pravadoline

Pravadoline Use and Manufacturing

An antiinflammatory and analgesic drug. Cannabinoid receptor agonist

Computed Properties

Molecular Weight:378.5
XLogP3:3.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:378.19434270
Monoisotopic Mass:378.19434270
Topological Polar Surface Area:43.7
Heavy Atom Count:28
Complexity:514
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes