Home > Name List By 3 > 3-[3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1, 1-diethylurea

CAS No 56980-93-9 , 3-[3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,
1-diethylurea

  • Name: 3-[3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,
    1-diethylurea
  • Synonyms: 56980-93-9; Celiprololum [INN-Latin]; CCRIS 3400;3-[3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,
    1-diethylurea;Celectol; EINECS 260-497-7; BRN 2776298; UL/1677; RHC 5320 A; RHC-5320A;
  • CAS Registry Number:
  • Density: 1.114 g/cm3
  • Refractive index: 1.545
  • EINECS: 260-497-7
  • Molecular Weight: 379.49372
  • InchiKey: JOATXPAWOHTVSZ-UHFFFAOYSA-N
  • InChI: InChI=1S/C20H33N3O4/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-
    13-16(25)12-21-20(4,5)6/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26)
  • Molecular Formula: C20H33N3O4
  • Molecular Structure:CAS No:56980-93-9 3-[3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,<br />1-diethylurea

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References of 3-[3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,
1-diethylurea
Title: Celiprolol
CAS Registry Number: 56980-93-9
CAS Name: N￠-[3-Acetyl-4-[3-[(1,1-dimethylethyl)amino]-2-hydroxypropoxy]phenyl]-N,N-diethylurea
Synonyms: N-[3-acetyl-4-(3￠-tert-butylamino-2￠-hydroxy)propoxy]phenyl-N￠-diethylurea
Manufacturers' Codes: ST-1396
Molecular Formula: C20H33N3O4
Molecular Weight: 379.49
Percent Composition: C 63.30%, H 8.76%, N 11.07%, O 16.86%
Literature References: Cardioselective b1-adrenergic blocker. Prepn: BE 823411; G. Z?lss et al., US 4034009 (1975, 1977 both to Chemie Linz). Hemodynamic effects: J. Bonelli et al., Wien. Klin. Wochenschr. 90, 350 (1978); H. Pittner, Arch. Pharmacol. 311, Suppl., 180 (1980). Series of articles on determn in biological material, pharmacology, toxicology, clinical studies: Arzneim.-Forsch. 33, 1-79 (1983). Toxicity: W. Wendtlandt, H. Pittner, ibid. 41. Symposium on pharmacology, clinical efficacy and comparison with other b-blockers: J. Cardiovasc. Pharmacol. 8, Suppl. 4, S1-S152 (1986). Comprehensive description: D. J. Mazzo et al., Anal. Profiles Drug Subs. 20, 237-301 (1991).
Properties: Crystals, mp 110-112°.
Melting point: mp 110-112°
 
Derivative Type: Hydrochloride
CAS Registry Number: 57470-78-7
Trademarks: Celectol (Sanofi-Aventis); Corliprol (Pharmacia & Upjohn); Selectol (Pharmacia)
Molecular Formula: C20H33N3O4.HCl
Molecular Weight: 415.95
Percent Composition: C 57.75%, H 8.24%, N 10.10%, O 15.39%, Cl 8.52%
Properties: White, odorless crystals, mp 197-200° (dec). Soly at ~25°C (g/100 ml): water 15.1, methanol 18.2, ethanol 1.61, chloroform 0.42. uv max (water): 231, 324 nm (E1% 652, 57); (0.01N HCl): 231, 324 nm (E1% 660, 60); (0.01N NaOH): 231, 324 nm (E1% 640, 60); (methanol): 232, 329 nm (E1% 775, 58). LD50 in male mice, rats (mg/kg): 56.2, 68.3 i.v.; 1834, 3826 orally (Wendtlandt, Pittner).
Melting point: mp 197-200° (dec)
Absorption maximum: uv max (water): 231, 324 nm (E1% 652, 57); (0.01N HCl): 231, 324 nm (E1% 660, 60); (0.01N NaOH): 231, 324 nm (E1% 640, 60); (methanol): 232, 329 nm (E1% 775, 58)
Toxicity data: LD50 in male mice, rats (mg/kg): 56.2, 68.3 i.v.; 1834, 3826 orally (Wendtlandt, Pittner)
 
Therap-Cat: Antihypertensive, antianginal.
Keywords: ?Adrenergic Blocker; Antianginal; Antihypertensive; Aryloxypropanolamine Derivatives.