
 BDBM50350338

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M  END

>  <Chemical Name>
BDBM50350338

>  <PubChem CID>
91930747

>  <Formula>
C25H23ClN6O3

>  <Molecular Weight>
490.948000

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

>  <XlogP>
2.7

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
4

>  <Canonical SMILES>
C1CN2C(=C(N(C2=O)C3CC3C4=CC=CC=C4)O)CN1C(=O)NC5=CC=NN5C6=CC(=CC=C6)Cl

>  <Isomeric SMILES>
C1CN2C(=C(N(C2=O)[C@H]3C[C@@H]3C4=CC=CC=C4)O)CN1C(=O)NC5=CC=NN5C6=CC(=CC=C6)Cl

>  <InChI Std. ID>
InChI=1S/C25H23ClN6O3/c26-17-7-4-8-18(13-17)32-22(9-10-27-32)28-24(34)29-11-12-30-21(15-29)23(33)31(25(30)35)20-14-19(20)16-5-2-1-3-6-16/h1-10,13,19-20,33H,11-12,14-15H2,(H,28,34)/t19-,20+/m1/s1

>  <InChI Key>
AZAWFDKMUKHFPT-UXHICEINSA-N

