Chloropretadalafil (Methyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(chloroacetyl)-2,3,4,9-tetrahydro-1H-pyrido-(3,4-b)indole-3-carboxylate)

cas: 171489-59-1 — see every product listed under this CAS number, including other names

Chloropretadalafil (Methyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(chloroacetyl)-2,3,4,9-tetrahydro-1H-pyrido-(3,4-b)indole-3-carboxylate) (CAS 171489-59-1) is a chemical reagent available from Chemat. Available pack sizes: 25mg, 100mg, 10mg. Offered by: Mikromol, LoGiCal.

brandMikromol
catalog numberMM0806.11-0025
cas171489-59-1
size25mg
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Structural formula: {0} (CAS {1})

Methyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate (CAS 171489-59-1) is a chemical compound with the molecular formula C22H19ClN2O5 and a molecular weight of 426.8 g/mol. IUPAC name: methyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate. InChIKey: JUKHNCNDFOAFLT-IIBYNOLFSA-N.

Identity
Molecular formulaC22H19ClN2O5
Molecular weight426.8 g/mol
IUPAC namemethyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate
InChIKeyJUKHNCNDFOAFLT-IIBYNOLFSA-N
SMILESCOC(=O)[C@H]1CC2=C([C@H](N1C(=O)CCl)C3=CC4=C(C=C3)OCO4)NC5=CC=CC=C25

Computed by PubChem (NCBI)

Synonyms: Chloropretadalafil, rel-Chloropretadalafil, C22H19ClN2O5, Tadalafil Impurity 17, Tadalafil Impurity 37, 2,5-dimethoxy, (Chloropretadalafil), orb3143675, JUKHNCNDFOAFLT-IIBYNOLFSA-N
Related forms of this compound
methyl (1R,3S)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate C22H19ClN2O5
methyl (1S,3S)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate C22H19ClN2O5
methyl (1S,3R)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate C22H19ClN2O5
methyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(2-chloroacetyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylate C22H19ClN2O5
Isomers (same molecular formula)
4-[[2-[5-chloro-2-[(4-methoxyphenyl)methoxy]phenyl]acetyl]amino]pyridine-2-carboxylic acid C22H19ClN2O5
4-[(1S,3R)-2-(2-chloroacetyl)-3-methoxycarbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]benzoic acid C22H19ClN2O5

Also listed as

Chloropretadalafil Chemat Brand CAS 171489-59-1
Chloropretadalafil, >95% (HPLC) TRC CAS 171489-59-1
Chloropretadalafil, >98.0%(HPLC)(T) TCI CAS 171489-59-1
Chloropretadalafil, 99.43% MedChemExpress CAS 171489-59-1
Chloropretadalafil (Standard) MedChemExpress CAS 171489-59-1
(1R,3R)-Methyl 1-(benzo[d][1,3]dioxol-5-yl)-2-(2-chloroacetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate, 98% Fluorochem CAS 171489-59-1
Chloropretadalafil 95% Ambeed CAS 171489-59-1
Chloropretadalafil, 95% Ambeed CAS 171489-59-1
Methyl (1R,3R)-1-(1,3-benzodioxol-5-yl)-2-(chloroacetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate, 98% Chemat CAS 171489-59-1
(1R,3R)-Methyl 1-(benzo[d][1,3]dioxol-5-yl)-2-(2-chloroacetyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylate, 95% BLDpharm CAS 171489-59-1