
 SCHEMBL15507270

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M  END

>  <Chemical Name>
SCHEMBL15507270

>  <PubChem CID>
89995647

>  <Formula>
C23H28FN3O4

>  <Molecular Weight>
429.492000

>  <IUPAC Name>
tert-butyl (3R,4R)-4-[cyclopropyl-[4-(1,3-oxazol-5-yl)benzoyl]amino]-3-fluoropiperidine-1-carboxylate

>  <XlogP>
3.5

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
CC(C)(C)OC(=O)N1CCC(C(C1)F)N(C2CC2)C(=O)C3=CC=C(C=C3)C4=CN=CO4

>  <Isomeric SMILES>
CC(C)(C)OC(=O)N1CC[C@H]([C@@H](C1)F)N(C2CC2)C(=O)C3=CC=C(C=C3)C4=CN=CO4

>  <InChI Std. ID>
InChI=1S/C23H28FN3O4/c1-23(2,3)31-22(29)26-11-10-19(18(24)13-26)27(17-8-9-17)21(28)16-6-4-15(5-7-16)20-12-25-14-30-20/h4-7,12,14,17-19H,8-11,13H2,1-3H3/t18-,19-/m1/s1

>  <InChI Key>
AFHFFFFBCSAHRO-RTBURBONSA-N

