General Information of the Compound
| Compound ID |
CP0458658
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| Compound Name |
4,4-bis(4-chlorophenyl)-6-(3-chlorophenylamino)-1-methyl-1H-benzo[d][1,3]oxazin-2(4H)-one
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| Structure |
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| Formula |
C27H19Cl3N2O2
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| Molecular Weight |
509.82
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| Canonical SMILES |
CN1C(=O)OC(c2ccc(Cl)cc2)(c2ccc(Cl)cc2)c2cc(Nc3cccc(Cl)c3)ccc12
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| InChI |
InChI=1S/C27H19Cl3N2O2/c1-32-25-14-13-23(31-22-4-2-3-21(30)15-22)16-24(25)27(34-26(32)33,17-5-9-19(28)10-6-17)18-7-11-20(29)12-8-18/h2-16,31H,1H3
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| InChIKey |
DPABUIRNVQEIGL-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