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Substance Name: Bibn 99
RN: 145301-48-0
InChIKey: LUPAFPUKESJDMZ-UHFFFAOYSA-N

Note

  • A highly selective M2 antagonist.

Molecular Formula

  • C31-H42-Cl-N5-O3

Molecular Weight

  • 568.158
 
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Names and Synonyms

Name of Substance

  • Bibn 99

Synonyms

  • Bibn-99
  • N-(3-(1-(2-(8-Chloro-5,6-dihydro-6-oxo-11H-pyrido(2,3-b)(1,4)benzodiazepin-11-yl)-2-oxoethyl)-4-piperidinyl)propyl)-N-ethyl-2,2-dimethylpentanamide

Systematic Name

  • Pentanamide, N-(3-(1-(2-(8-chloro-5,6-dihydro-6-oxo-11H-pyrido(2,3-b)(1,4)benzodiazepin-11-yl)-2-oxoethyl)-4-piperidinyl)propyl)-N-ethyl-2,2-dimethyl-

Registry Numbers

CAS Registry Number

  • 145301-48-0

System Generated Number

  • 0145301480

Structure Descriptors

InChI

1S/C31H42ClN5O3/c1-5-15-31(3,4)30(40)36(6-2)17-8-9-22-13-18-35(19-14-22)21-27(38)37-26-12-11-23(32)20-24(26)29(39)34-25-10-7-16-33-28(25)37/h7,10-12,16,20,22H,5-6,8-9,13-15,17-19,21H2,1-4H3,(H,34,39)

InChIKey

LUPAFPUKESJDMZ-UHFFFAOYSA-N

Smiles

C(C(CCC)(C)C)(=O)N(CC)CCCC1CCN(CC1)CC(=O)N1c2c(NC(c3c1ccc(c3)Cl)=O)cccn2