Butenafine Hydrochloride

HCID 443867CAS 101827-46-7

基本情報

標準SMILES: CN(Cc1ccc(C(C)(C)C)cc1)Cc1cccc2ccccc12.Cl
InChIKey: LJBSAUIFGPSHCN-UHFFFAOYSA-N
分子式: C23H28ClN
平均分子量: 353.9 g/mol
単同位体質量: 353.19102758

概要

Butenafine hydrochloride is the hydrochloride salt of butenafine. An inhibitor of squalene epoxidase, an enzyme responsible for the creation of sterols needed in fungal cell membranes, it is used for treatment of dermatological fungal infections. It has a role as an EC 1.14.13.132 (squalene monooxygenase) inhibitor and an antifungal drug. It is a hydrochloride and an ammonium salt. It contains a butenafine.

名称と識別子

優先名称: Butenafine Hydrochloride
IUPAC: 1-(4-tert-butylphenyl)-N-methyl-N-(naphthalen-1-ylmethyl)methanamine;hydrochloride

名称と別名

Butenafine hydrochloride101827-46-7Butenafine HCLMentaxVolleyKP-363Mentax-TCN-(p-tert-Butylbenzyl)-N-methyl-1-naphthalenemethylamine hydrochlorideDTXSID2048589Lotrimin UltraJock Itch CreamAthletes Foot Ultra

名称をさらに表示

R8XA2029ZICHEBI:31325Lotrimin Ultra RingwormN-4-tert-Butylbenzyl-N-methyl-1-naphthalenemethylamine hydrochlorideDTXCID20285151-Naphthalenemethanamine, N-((4-(1,1-dimethylethyl)phenyl)methyl)-N-methyl-, hydrochlorideN-((4-(1,1-Dimethylethyl)phenyl)methyl)-N-methyl-1-naphthalenemethanamine hydrochlorideN-[[4-(1,1-Dimethylethyl)phenyl]methyl]-N-methyl-1-naphthalenemethanamine hydrochloride

データベース識別子

CAS: 101827-46-7
PubChem CID: 443867
DTXSID: DTXSID2048589
ChEMBL: CHEMBL1200397
ChEBI: CHEBI:31325
UNII: R8XA2029ZI
EC Number: 642-354-4

物性

構造計算による物性

極性表面積: 3.2 Å²
水素結合供与体数: 1
水素結合受容体数: 1
回転可能結合数: 5
重原子数: 25
形式電荷: 0
複雑度: 374

実験および物理化学的性質

Human Drugs · 3 件

Breast Feeding; Lactation; Milk, Human; Anti-Infective Agents; Antifungal Agents

FDA approved drugs -> Active ingredient

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H312 (97.6%): Harmful in contact with skin [Warning Acute toxicity, dermal]

P280, P302+P352, P317, P321, P362+P364, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 2 notifications to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (97.6%)

毒性情報

Effects During Pregnancy and Lactation◉ Summary of Use during Lactation

化学と産業

薬理情報

FDA Pharmacological Classification · 2 件

BUTENAFINE HYDROCHLORIDE

Benzylamines [CS]; Benzylamine Antifungal [EPC]

MeSH Pharmacological ClassificationSubstances that destroy fungi by suppressing their ability to grow or reproduce. They differ from FUNGICIDES, INDUSTRIAL because they defend against fungi present in human or animal tissues.