General Information of the Compound
| Compound ID |
CP0084621
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| Compound Name |
3-(4-Benzyloxy-phenyl)-1-(2-hydroxy-1-methyl-2-phenyl-ethyl)-1-methyl-urea
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| Structure |
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| Formula |
C24H26N2O3
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| Molecular Weight |
390.483
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| Canonical SMILES |
C[C@H]([C@@H](O)c1ccccc1)N(C)C(=O)Nc1ccc(OCc2ccccc2)cc1
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| InChI |
InChI=1S/C24H26N2O3/c1-18(23(27)20-11-7-4-8-12-20)26(2)24(28)25-21-13-15-22(16-14-21)29-17-19-9-5-3-6-10-19/h3-16,18,23,27H,17H2,1-2H3,(H,25,28)/t18-,23-/m1/s1
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| InChIKey |
ZSGWAXUJSNQKLZ-WZONZLPQSA-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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