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Substance Name: 4(1H)-Quinazolinone, 2,3-dihydro-2-methyl-3-phenyl-1-(piperidinoacetyl)-, monohydrochloride, hydrate
RN: 16711-39-0
InChIKey: HNILUTUMKDATLF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H25-N3-O2.Cl-H.H2-O

Molecular Weight

  • 417.934
 
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Names and Synonyms

Synonym

  • 2,3-Dihydro-2-methyl-3-phenyl-1-(piperidinoacetyl)-4(1H)-quinazolinone HCl hydrate

Systematic Name

  • 4(1H)-Quinazolinone, 2,3-dihydro-2-methyl-3-phenyl-1-(piperidinoacetyl)-, monohydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 16711-39-0

System Generated Number

  • 0016711390

Molecular Formulas

Molecular Formula

  • C22-H25-N3-O2.Cl-H.H2-O

Molecular Formula Fragments

  • C22-H25-N3-O2
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C22H25N3O2.ClH.H2O/c1-17-24(18-10-4-2-5-11-18)22(27)19-12-6-7-13-20(19)25(17)21(26)16-23-14-8-3-9-15-23;;/h2,4-7,10-13,17H,3,8-9,14-16H2,1H3;1H;1H2

InChIKey

HNILUTUMKDATLF-UHFFFAOYSA-N

Smiles

c1ccc2c(N(C(CN3CCCCC3)=O)[C@@H](N(c3ccccc3)C2=O)C)c1.Cl.O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 216mg/kg (216mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 11, Pg. 348, 1968.
mouse LD50 oral 740mg/kg (740mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 11, Pg. 348, 1968.