General Information of the Compound
| Compound ID |
CP0058573
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| Compound Name |
5-chloro-3-[4-[[ethyl(methyl)sulfamoyl]amino]-2,6-difluorobenzoyl]-1H-pyrrolo[2,3-b]pyridine
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| Structure |
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| Formula |
C17H15ClF2N4O3S
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| Molecular Weight |
428.848
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| Canonical SMILES |
CCN(C)S(=O)(=O)Nc1cc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c(F)c1
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| InChI |
InChI=1S/C17H15ClF2N4O3S/c1-3-24(2)28(26,27)23-10-5-13(19)15(14(20)6-10)16(25)12-8-22-17-11(12)4-9(18)7-21-17/h4-8,23H,3H2,1-2H3,(H,21,22)
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| InChIKey |
JLIADOPNPNQIHY-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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