General Information of the Compound
| Compound ID |
CP0063755
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| Compound Name |
6-[4-(Trifluoromethyl)phenyl]-3,4-dihydro-2(1H)-quinolinone
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| Structure |
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| Formula |
C16H12F3NO
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| Molecular Weight |
291.272
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1)-c1ccc2NC(=O)CCc2c1
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| InChI |
InChI=1S/C16H12F3NO/c17-16(18,19)13-5-1-10(2-6-13)11-3-7-14-12(9-11)4-8-15(21)20-14/h1-3,5-7,9H,4,8H2,(H,20,21)
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| InChIKey |
WNVWLPPJRMIRBG-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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Table of Molecular Bioactivities Related to the Compound