General Information of the Compound
| Compound ID |
CP0497676
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| Compound Name |
N,N-diethyl-2-(4-methyl-N-[4-(trifluoromethoxy)phenyl]sulfonylanilino)acetamide
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| Structure |
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| Formula |
C20H23F3N2O4S
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| Molecular Weight |
444.475
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| Canonical SMILES |
CCN(CC)C(=O)CN(c1ccc(C)cc1)S(=O)(=O)c1ccc(OC(F)(F)F)cc1
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| InChI |
InChI=1S/C20H23F3N2O4S/c1-4-24(5-2)19(26)14-25(16-8-6-15(3)7-9-16)30(27,28)18-12-10-17(11-13-18)29-20(21,22)23/h6-13H,4-5,14H2,1-3H3
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| InChIKey |
ZXCOMJKMQVAETR-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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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01132, Orexin receptor type 2
Protein ID: PT02001, Orexin/Hypocretin receptor type 1