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Substance Name: 4(1H)-Quinazolinone, 2,3-dihydro-1-(2-(4-hydroxy-4-phenyl-1-piperidinyl)ethyl)-2-phenyl-, monomethanesulfonate (salt)
RN: 65883-91-2
InChIKey: ADQPYLYWJCURDH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H29-N3-O2.C-H4-O3-S

Molecular Weight

  • 523.651
 
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Names and Synonyms

Synonym

  • Compound 776-278

Systematic Name

  • 4(1H)-Quinazolinone, 2,3-dihydro-1-(2-(4-hydroxy-4-phenyl-1-piperidinyl)ethyl)-2-phenyl-, monomethanesulfonate (salt)

Registry Numbers

CAS Registry Number

  • 65883-91-2

System Generated Number

  • 0065883912

Molecular Formulas

Molecular Formula

  • C27-H29-N3-O2.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C27-H29-N3-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C27H29N3O2.CH4O3S/c31-26-23-13-7-8-14-24(23)30(25(28-26)21-9-3-1-4-10-21)20-19-29-17-15-27(32,16-18-29)22-11-5-2-6-12-22;1-5(2,3)4/h1-14,25,32H,15-20H2,(H,28,31);1H3,(H,2,3,4)

InChIKey

ADQPYLYWJCURDH-UHFFFAOYSA-N

Smiles

c1cc2N(CCN3CCC(CC3)(c3ccccc3)O)[C@@H](c3ccccc3)NC(=O)c2cc1.S(=O)(=O)(C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 300mg/kg (300mg/kg)   United States Patent Document. Vol. #4205173,