1163-36-6
Product Name:
Clemizole hydrochloride
Formula:
C19H21Cl2N3
Synonyms:
1-(p-Chlorobenzyl)-2-(1-pyrrolidinylmethyl)benzimidazole hydrochloride;1-(p-Chlorobenzyl)-2-pyrrolidylmethylenebenzimidazole hydrochloride;1-[(4-Chlorophenyl)methyl]-2-(1-pyrrolidinylmethyl)-1H-benzimidazole hydrochloride;CID 2782 hydrochloride;NSC 46261 hydrochloride
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 49.5 [ug/mL] (The mean of the results at pH 7.4) |
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Collision Cross Section | 179.8 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards] |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H302:Acute toxicity,oral |
COMPUTED DESCRIPTORS
Molecular Weight | 362.3 g/mol |
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Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 4 |
Exact Mass | 361.1112531 g/mol |
Monoisotopic Mass | 361.1112531 g/mol |
Topological Polar Surface Area | 21.1 Ų |
Heavy Atom Count | 24 |
Formal Charge | 0 |
Complexity | 377 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 2 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Clemizole hydrochloride is a member of benzimidazoles.