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Substance Name: SGD-1882
RN: 1222490-34-7
UNII: IRE1I9FE08
InChIKey: OMRPLUKQNWNZAV-CONSDPRKSA-N

Molecular Formula

  • C42-H39-N5-O7

Molecular Weight

  • 725.7981
 
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Names and Synonyms

Name of Substance

  • SGD-1882

Synonyms

  • 5H-Pyrrolo(2,1-C)(1,4)benzodiazepin-5-one, 2-(4-aminophenyl)-8-(3-(((11aS)-5,11a-dihydro-7-methoxy-2-(4-methoxyphenyl)-5-oxo-1H-pyrrolo(2,1-C)(1,4)benzodiazepin-8-yl)oxy)propoxy)-1,11a-dihydro-7-methoxy-, (11aS)-
  • 8-(3-((2-(4-Aminophenyl)-7-methoxy-5-oxo-1,11abeta-dihydro-5H-pyrrolo(2,1-C)(1,4)benzodiazepine-8-yl)oxy)propoxy)-7-methoxy-2-(4-methoxyphenyl)-1,11abeta-dihydro-5H-pyrrolo(2,1-C)(1,4)benzodiazepine-5-one
  • J3.194.362K
  • Pbd dimer
  • SGD-1882
  • UNII-IRE1I9FE08

Registry Numbers

CAS Registry Number

  • 1222490-34-7

FDA UNII

  • IRE1I9FE08

System Generated Number

  • 1222490347

Structure Descriptors

InChI

1S/C42H39N5O7/c1-50-32-11-7-26(8-12-32)28-16-31-22-45-36-20-40(38(52-3)18-34(36)42(49)47(31)24-28)54-14-4-13-53-39-19-35-33(17-37(39)51-2)41(48)46-23-27(15-30(46)21-44-35)25-5-9-29(43)10-6-25/h5-12,17-24,30-31H,4,13-16,43H2,1-3H3/t30-,31-/m0/s1

InChIKey

OMRPLUKQNWNZAV-CONSDPRKSA-N

Smiles

COc1ccc(cc1)C2=CN3[C@@H](C2)C=Nc4cc(OCCCOc5cc6N=C[C@@H]7CC(=CN7C(=O)c6cc5OC)c8ccc(N)cc8)c(OC)cc4C3=O