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Substance Name: BIIE-0246
RN: 246146-55-4
UNII: N3Z657H81X
InChIKey: RSJAXPUYVJKAAA-JPGJPTAESA-N

Note

  • A neuropeptide Y Y2 receptor antagonist.

Molecular Formula

  • C49-H57-N11-O6

Molecular Weight

  • 896.0603
 
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Names and Synonyms

Name of Substance

  • BIIE-0246

Synonyms

  • Ar-H-053591
  • BIIE-0246
  • Cyclopentaneacetamide, N-((1S)-4-((aminoiminomethyl)amino)-1-(((2-(3,5-dioxo-1,2-diphenyl-1,2,4-triazolidin-4-yl)ethyl)amino)carbonyl)butyl)-1-(2-(4-(6,11-dihydro-6-oxo-5H-dibenz(b,E)azepin-11-yl)-1-piperazinyl)-2-oxoethyl)-
  • UNII-N3Z657H81X

Registry Numbers

CAS Registry Number

  • 246146-55-4

FDA UNII

  • N3Z657H81X

System Generated Number

  • 0246146554

Structure Descriptors

InChI

1S/C49H57N11O6/c50-46(51)53-25-13-22-40(45(64)52-26-27-58-47(65)59(34-14-3-1-4-15-34)60(48(58)66)35-16-5-2-6-17-35)54-41(61)32-49(23-11-12-24-49)33-42(62)56-28-30-57(31-29-56)43-36-18-7-8-19-37(36)44(63)55-39-21-10-9-20-38(39)43/h1-10,14-21,40,43H,11-13,22-33H2,(H,52,64)(H,54,61)(H,55,63)(H4,50,51,53)/t40-,43?/m0/s1

InChIKey

RSJAXPUYVJKAAA-JPGJPTAESA-N

Smiles

c1ccc(cc1)n2c(=O)n(c(=O)n2c3ccccc3)CCNC(=O)[C@H](CCCNC(=N)N)NC(=O)CC4(CCCC4)CC(=O)N5CCN(CC5)C6c7ccccc7C(=O)Nc8c6cccc8