
 BDBM50349294

 51 55  0  0  0  0  0  0  0  0999 V2000
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   -3.9787    3.5636   -4.3270 F   0  0  0  0  0
   -0.2465    0.9190   -2.2744 Cl  0  0  0  0  0
   -0.5979    0.1055    3.5982 H   0  0  0  0  0
   -0.9439    1.5120    2.5938 H   0  0  0  0  0
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M  END

>  <Chemical Name>
BDBM50349294

>  <PubChem CID>
91930670

>  <Formula>
C22H19Cl2FN4O3

>  <Molecular Weight>
477.317000

>  <IUPAC Name>
N-(2,6-dichloro-4-fluorophenyl)-1-hydroxy-3-oxo-2-[(1S,2R)-2-phenylcyclopropyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide

>  <XlogP>
3.1

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1CN2C(=C(N(C2=O)C3CC3C4=CC=CC=C4)O)CN1C(=O)NC5=C(C=C(C=C5Cl)F)Cl

>  <Isomeric SMILES>
C1CN2C(=C(N(C2=O)[C@H]3C[C@@H]3C4=CC=CC=C4)O)CN1C(=O)NC5=C(C=C(C=C5Cl)F)Cl

>  <InChI Std. ID>
InChI=1S/C22H19Cl2FN4O3/c23-15-8-13(25)9-16(24)19(15)26-21(31)27-6-7-28-18(11-27)20(30)29(22(28)32)17-10-14(17)12-4-2-1-3-5-12/h1-5,8-9,14,17,30H,6-7,10-11H2,(H,26,31)/t14-,17+/m1/s1

>  <InChI Key>
ADIHLQVAMJMPDL-PBHICJAKSA-N

