OPC 31260 塩酸塩
Mozavaptan Hydrochloride
基本情報
- CAS
138470-70-9- 標準SMILES
Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)C)c3ccccc32)cc1.Cl- InChIKey
MOROBKPIULFQDC-UHFFFAOYSA-N- 分子式
- C27H30ClN3O2
- 平均分子量
- 464 g/mol
- 単同位体質量
- 463.2026549
概要
Mozavaptane hydrochloride is a member of benzamides. It has a role as an aquaretic.
名称と識別子
- 優先名称
- Mozavaptan Hydrochloride
- IUPAC
- N-[4-[5-(dimethylamino)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]phenyl]-2-methylbenzamide;hydrochloride
- 現地名
- OPC 31260 塩酸塩
- 英語名
- Mozavaptan Hydrochloride
- 分子式
- C27H29N3O2.ClH
- 分子量
- 464.006
名称と別名
Mozavaptan hydrochloride138470-70-9PhysulineMozavaptane hydrochlorideF39AR1YW1Obenzamide, N-(4-((5-(dimethylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl)carbonyl)phenyl)-2-methyl-, hydrochloride (1:1)Benzamide, N-[4-[[5-(dimethylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]carbonyl]phenyl]-2-methyl-, hydrochloride (1:1)RefChem:159856mozavaptan HClMozavaptan (hydrochloride)OPC 31260 hydrochlorideMFCD11111965
名称をさらに表示
OPC 31260 塩酸塩モザバプタン塩酸塩モザバプタン塩酸塩 (JAN)塩酸モザバプタンMOROBKPIULFQDC-UHFFFAOYSA-NOPC 31260 hydrochloride >=98% (HPLC)N-[4-(5-Dimethylamino-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)phenyl]-2-methylbenzamide hydrochlorideN-[4-[[5-(Dimethylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]carbonyl]phenyl]-2-methylbenzamide hydrochlorideBenzamide,N-[4-[[5-(dimethylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]carbonyl]phenyl]-2-methyl-,hydrochloride (1:1)
OPC-31260 (hydrochloride)5-(Dimethylamino)-1-[4-(2-methylbenzamido)benzoyl]-2,3,4,5-tetrahydro-1H-benzazepine hydrochlorideN-(4-(5-(Dimethylamino)-2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carbonyl)phenyl)-2-methylbenzamide hydrochlorideMozavaptane hydrochloride (JAN)MOZAVAPTANE HYDROCHLORIDE [JAN]UNII-F39AR1YW1O138470-70-9 (HCl)OPC-31260 hydrochloride?
データベース識別子
- CAS
138470-70-9- PubChem CID
- 636389
- DTXSID
DTXSID90930125- ChEMBL
CHEMBL5087555- ChEBI
CHEBI:31869- UNII
- F39AR1YW1O
- EC Number
- 689-426-1
物性
構造計算による物性
- 極性表面積
- 52.7 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 3
- 回転可能結合数
- 4
- 重原子数
- 33
- 形式電荷
- 0
- 複雑度
- 643
物理化学的性質
- 貯蔵温度
- 2 · 2-8°C
- 溶解性
- 15 mg/mL以上 · DMSO：15mg/mL以上
- 外見
- 粉
- 色
- 白から黄褐色
- InChIKey
- MOROBKPIULFQDC-UHFFFAOYSA-N
- SMILES
- Cl.CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c4ccccc14
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
危険有害性情報
Hazard Classes and CategoriesAcute Tox. 4 (100%)
安全データ
- wgk
- 3
- risk_code
- 22
- hazard_code
- Xn
- Hazard Classifications
- Acute Tox. 4 Oral
- ストレージクラス
- 11 - Combustible Solids
化学と産業
薬理情報
MeSH Pharmacological ClassificationEndogenous compounds and drugs that inhibit or block the activity of ANTIDUIRETIC HORMONE RECEPTORS.
応用分野
使用Mozavaptan is a benzazepine derivative that antagonizes the binding of arginine vasopressin (AVP) to vasopressin receptors located in the liver (V1; IC50 = 1.2 μM) and kidney (V2; IC50 = 14 nM). At 10-100 μg/kg, mozavaptan can inhibit the antidiuretic action of AVP, promoting aquaresis when administered intravenously to rats. The therapeutic potential of mozavaptan in ectopic antidiuretic hormone syndrome, heart failure, and other complications related to hyponatremia has been studied.
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