Chemical Compound

4-((5aS,6S,9R)-3-chloro-1-fluoro-13-(((2R,7aS)-2-fluorohexahydro-1H-pyrrolizin-7a-yl)methoxy)-5a,6,7,8,9,10-hexahydro-5H-6,9-epiminoazepino[2',1':3,4][1,4]oxazepino[5,6,7-de]quinazolin-2-yl)benzo[d]thiazol-2-amine, atropisomer 1 (compound I-12-1)

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4-((5aS,6S,9R)-3-chloro-1-fluoro-13-(((2R,7aS)-2-fluorohexahydro-1H-pyrrolizin-7a-yl)methoxy)-5a,6,7,8,9,10-hexahydro-5H-6,9-epiminoazepino[2',1':3,4][1,4]oxazepino[5,6,7-de]quinazolin-2-yl)benzo[d]thiazol-2-amine, atropisomer 1 (compound I-12-1) 结构式
Primary record

4-((5aS,6S,9R)-3-chloro-1-fluoro-13-(((2R,7aS)-2-fluorohexahydro-1H-pyrrolizin-7a-yl)methoxy)-5a,6,7,8,9,10-hexahydro-5H-6,9-epiminoazepino[2',1':3,4][1,4]oxazepino[5,6,7-de]quinazolin-2-yl)benzo[d]thiazol-2-amine, atropisomer 1 (compound I-12-1)

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
167294382
SMILES
C1C[C@]2(C[C@H](CN2C1)F)COC3=NC4=C5C(=C(C(=C4F)C6=C7C(=CC=C6)SC(=N7)N)Cl)OC[C@@H]8[C@@H]9CC[C@@H](N9)CN8C5=N3
Canonical SMILES
Nc1nc2c(-c3c(Cl)c4c5c(nc(OC[C@@]67CCCN6C[C@H](F)C7)nc5c3F)N3C[C@H]5CC[C@H](N5)[C@H]3CO4)cccc2s1

名称与同义词

  • SCHEMBL24857804
  • BDBM699144
  • US20240327425, Compound I-12-2
  • 4-((5aS,6S,9R)-3-chloro-1-fluoro-13-(((2R,7aS)-2-fluorohexahydro-1H-pyrrolizin-7a-yl)methoxy)-5a,6,7,8,9,10-hexahydro-5H-6,9-epiminoazepino[2',1':3,4][1,4]oxazepino[5,6,7-de]quinazolin-2-yl)benzo[d]thiazol-2-amine, atropisomer 1 (compound I-12-1)