General Information of the Compound
| Compound ID |
CP0192328
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| Compound Name |
2-chloro-N-[1,2-dioxo-1-(1H-pyrazol-5-ylamino)pentan-3-yl]-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C16H14ClF3N4O3
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| Molecular Weight |
402.76
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| Canonical SMILES |
CCC(NC(=O)c1cccc(c1Cl)C(F)(F)F)C(=O)C(=O)Nc1ccn[nH]1
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| InChI |
InChI=1S/C16H14ClF3N4O3/c1-2-10(13(25)15(27)23-11-6-7-21-24-11)22-14(26)8-4-3-5-9(12(8)17)16(18,19)20/h3-7,10H,2H2,1H3,(H,22,26)(H2,21,23,24,27)
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| InChIKey |
VKQOQWWJCCFELL-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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