Py-MPB-amino-C3-PBD

Catalog No. :
ACTBVV702
CAS No. :
2412924-07-1
Molecular Formula :
C41H44N8O6
Molecular Weight :
744.85

IUPAC Name:(S)-4-(4-((2-methoxy-12-oxo-5,6,6a,7,8,9,10,12-octahydrobenzo[e]pyrido[1,2-a][1,4]diazepin-3-yl)oxy)butanamido)-1-methyl-N-(4-(1-methyl-5-(pyridin-4-ylcarbamoyl)-1H-pyrrol-3-yl)phenyl)-1H-pyrrole-2-carboxamide

Py-MPB-amino-C3-PBD structure diagram
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Product Information

Product NamePy-MPB-amino-C3-PBD
IUPAC Name(S)-4-(4-((2-methoxy-12-oxo-5,6,6a,7,8,9,10,12-octahydrobenzo[e]pyrido[1,2-a][1,4]diazepin-3-yl)oxy)butanamido)-1-methyl-N-(4-(1-methyl-5-(pyridin-4-ylcarbamoyl)-1H-pyrrol-3-yl)phenyl)-1H-pyrrole-2-carboxamide
Molecular FormulaC41H44N8O6
Molecular Weight744.85
SMILESO=C1C2=CC(OC)=C(OCCCC(NC3=CN(C)C(C(NC4=CC=C(C5=CN(C)C(C(NC6=CC=NC=C6)=O)=C5)C=C4)=O)=C3)=O)C=C2NC[C@@]7([H])N1CCCC7
InChI KeyKZQHDCMQELKFIS-HKBQPEDESA-N
SynonymPy-MPB-amino-C3-PBD;Py-MPB-amino-C-3-PBD,Py MPB amino C3 PBD,PyMPBaminoC3PBD;1H-Pyrrole-2-carboxamide, 1-methyl-4-[4-[[[1-methyl-4-[[4-[[(6aS)-5,6,6a,7,8,9,10,12-octahydro-2-methoxy-12-oxopyrido[2,1-c][1,4]benzodiazepin-3-yl]oxy]-1-oxobutyl]amino]-1H-pyrrol-2-yl]carbonyl]amino]phenyl]-N-4-pyridinyl-
CAS No.2412924-07-1

Synthetic Route by SureRoute

1. ACTBVV702 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACTBVV702 route product structure diagram
    ACTBVV7022412924-07-1
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2. ACTBVV702 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACTBVV702 route product structure diagram
    ACTBVV7022412924-07-1
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