General Information of the Compound
| Compound ID |
CP0167187
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| Compound Name |
4-hydroxy-piperidine-1-carboxylic acid 4-(5-trifluoromethylpyridin-2-yloxy)-phenyl ester
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| Structure |
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| Formula |
C18H17F3N2O4
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| Molecular Weight |
382.338
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| Canonical SMILES |
OC1CCN(CC1)C(=O)Oc1ccc(Oc2ccc(cn2)C(F)(F)F)cc1
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| InChI |
InChI=1S/C18H17F3N2O4/c19-18(20,21)12-1-6-16(22-11-12)26-14-2-4-15(5-3-14)27-17(25)23-9-7-13(24)8-10-23/h1-6,11,13,24H,7-10H2
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| InChIKey |
CKHKKOJRCBFWTB-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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