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Substance Name: Barnidipine hydrochloride [JAN]
RN: 104757-53-1
UNII: 7LZ6R3AEM1
InChIKey: XEMPUKIZUCIZEY-YSCHMLPRSA-N

Classification Codes

  • Calcium Channel Blockers
  • Drug / Therapeutic Agent
  • Reproductive Effect

Molecular Formula

  • C27-H29-N3-O6.Cl-H

Molecular Weight

  • 528.002
 
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Names and Synonyms

Name of Substance

  • Barnidipine hydrochloride
  • Barnidipine hydrochloride [JAN]

Synonyms

  • (S-(R*,R*))-Methyl 1-(phenylmethyl)-3-pyrrolidinyl 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate
  • Barnidipine HCl
  • Barnidipine hydrochloride
  • LY198561
  • Mepirodipine hydrochloride
  • UNII-7LZ6R3AEM1
  • YM09730-5
  • YM730

Systematic Names

  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, methyl 1-(phenylmethyl)-3-pyrrolidinyl ester, hydrochloride, (S-(R*,R*))-
  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, methyl 1-(phenylmethyl)-3-pyrrolidinyl ester, monohydrochloride, (S-(R*,R*))-

Registry Numbers

CAS Registry Number

  • 104757-53-1

FDA UNII

  • 7LZ6R3AEM1

System Generated Number

  • 0104757531

Molecular Formulas

Molecular Formula

  • C27-H29-N3-O6.Cl-H

Molecular Formula Fragments

  • C27-H29-N3-O6
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C27H29N3O6.ClH/c1-17-23(26(31)35-3)25(20-10-7-11-21(14-20)30(33)34)24(18(2)28-17)27(32)36-22-12-13-29(16-22)15-19-8-5-4-6-9-19;/h4-11,14,22,25,28H,12-13,15-16H2,1-3H3;1H/t22-,25-;/m0./s1

InChIKey

XEMPUKIZUCIZEY-YSCHMLPRSA-N

Smiles

Cl.COC(=O)C1=C(C)NC(=C([C@H]1c2cccc(c2)[N+](=O)[O-])C(=O)O[C@H]3CCN(Cc4ccccc4)C3)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LDLo oral 30mg/kg (30mg/kg)   Kiso to Rinsho. Clinical Report. Vol. 24, Pg. 4357, 1990.
mouse LD50 intravenous 3400ug/kg (3.4mg/kg)   Kiso to Rinsho. Clinical Report. Vol. 24, Pg. 4383, 1990.
mouse LD50 intravenous 3400ug/kg (3.4mg/kg) SKIN AND APPENDAGES (SKIN): HAIR: OTHER

SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE
Kiso to Rinsho. Clinical Report. Vol. 24, Pg. 4383, 1990.
mouse LD50 oral 108mg/kg (108mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
Kiso to Rinsho. Clinical Report. Vol. 24, Pg. 4383, 1990.
mouse LD50 subcutaneous 17100ug/kg (17.1mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
Kiso to Rinsho. Clinical Report. Vol. 24, Pg. 4383, 1990.
rat LD50 intravenous 5100ug/kg (5.1mg/kg) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: TREMOR
Kiso to Rinsho. Clinical Report. Vol. 24, Pg. 4383, 1990.
rat LD50 oral 105mg/kg (105mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
Kiso to Rinsho. Clinical Report. Vol. 24, Pg. 4383, 1990.
rat LD50 subcutaneous 29900ug/kg (29.9mg/kg) SENSE ORGANS AND SPECIAL SENSES: PTOSIS: EYE

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Kiso to Rinsho. Clinical Report. Vol. 24, Pg. 4383, 1990.