General Information of the Compound
| Compound ID |
CP0957497
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| Compound Name |
4-Methoxybenzyl 2-oxo-6-pentyl-4-phenyl-1,2,3,4-tetrahydropyrimidine-5-carboxylate
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| Structure |
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| Formula |
C24H28N2O4
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| Molecular Weight |
408.498
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| Canonical SMILES |
CCCCCC1=C(C(=O)OCc2ccc(OC)cc2)C(c2ccccc2)NC(=O)N1
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| InChI |
InChI=1S/C24H28N2O4/c1-3-4-6-11-20-21(22(26-24(28)25-20)18-9-7-5-8-10-18)23(27)30-16-17-12-14-19(29-2)15-13-17/h5,7-10,12-15,22H,3-4,6,11,16H2,1-2H3,(H2,25,26,28)
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| InChIKey |
QOIWXCNFPYPDKM-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