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Substance Name: AHR-5645B
RN: 102585-97-7
UNII: RB3RAZ5FWL
InChIKey: UUTCSRWJAKFMIJ-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H27-N3-O.C4-H4-O4

Molecular Weight

  • 417.503
 
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Names and Synonyms

Name of Substance

  • AHR-5645B

Synonyms

  • 4-Amino-N-(1-cyclohexyl-3-pyrrolidinyl)-N-methylbenzamide fumarate
  • AHR-5645 B
  • Fumarate d'amino-4 N-(cyclohexyl-1-pyrrolidinyl-3) N-methyl benzamide
  • p-Amino-N-(1-cyclohexyl-3-pyrrolidinyl)-N-methylbenzamide fumarate
  • UNII-RB3RAZ5FWL

Systematic Name

  • Benzamide, p-amino-N-(1-cyclohexyl-3-pyrrolidinyl)-N-methyl-, fumarate

Registry Numbers

CAS Registry Number

  • 102585-97-7

FDA UNII

  • RB3RAZ5FWL

System Generated Number

  • 0102585977

Molecular Formulas

Molecular Formula

  • C18-H27-N3-O.C4-H4-O4

Molecular Formula Fragments

  • C18-H27-N3-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C18H27N3O.C4H4O4/c1-20(18(22)14-7-9-15(19)10-8-14)17-11-12-21(13-17)16-5-3-2-4-6-16;5-3(6)1-2-4(7)8/h7-10,16-17H,2-6,11-13,19H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

UUTCSRWJAKFMIJ-WLHGVMLRSA-N

Smiles

C1([N@@H+]2C[C@@H](CC2)N(C)C(c2ccc(N)cc2)=O)CCCCC1.C(=C\C(=O)[O-])\C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 208mg/kg (208mg/kg)   Therapie. Vol. 32, Pg. 121, 1977.
mouse LD50 oral 450mg/kg (450mg/kg)   Therapie. Vol. 32, Pg. 121, 1977.