4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine;trihydrochloride
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![4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine;trihydrochloride structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/44729cff11514f4ba9f42b568b301ee1.png "4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine;trihydrochloride")
4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine;trihydrochloride
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CAS No:
56575-29-2
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Formula:
C33H41Cl4N3O3
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Chemical Name:
4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine;trihydrochloride
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Synonyms:
Ancoloxin;56575-29-2;Davodoxine;Postadoxine;Meclizine / pyridoxine;5-Hydroxy-6-methyl-3,4-pyridinedimethanol hydrochloride, mixt. with 1-((4-chlorophenyl)phenylmethyl)-4-((3-methylphenyl)methyl)piperazine dihydrochloride;DTXSID00972016;Meclizine hydrochloride mixture with pyridoxine hydrochloride;3,4-Pyridinedimethanol, 5-hydroxy-6-methyl-, hydrochloride, mixt. with 1-((4-chlorophenyl)phenylmethyl)-4-((3-methylphenyl)methyl)piperazine dihydrochloride;4,5-Bis(hydroxymethyl)-2-methylpyridin-3-ol--1-[(4-chlorophenyl)(phenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine--hydrogen chloride (1/1/3)
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CAS No:
4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;1-[(4-chlorophenyl)-phenylmethyl]-4-[(3-methylphenyl)methyl]piperazine;trihydrochloride Basic Attributes
669.5 g/mol
669.187253 g/mol
Computed Properties
Molecular Weight:669.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:669.187253
Monoisotopic Mass:667.190203
Topological Polar Surface Area:80.1
Heavy Atom Count:43
Complexity:590
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:5
Compound Is Canonicalized:Yes
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