General Information of the Compound
| Compound ID |
CP0536372
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| Compound Name |
ethyl 7-[3-[(3-chlorophenyl)carbamoylamino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate
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| Structure |
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| Formula |
C22H18ClN5O3
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| Molecular Weight |
435.871
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| Canonical SMILES |
CCOC(=O)c1cnn2c(ccnc12)-c1cccc(NC(=O)Nc2cccc(Cl)c2)c1
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| InChI |
InChI=1S/C22H18ClN5O3/c1-2-31-21(29)18-13-25-28-19(9-10-24-20(18)28)14-5-3-7-16(11-14)26-22(30)27-17-8-4-6-15(23)12-17/h3-13H,2H2,1H3,(H2,26,27,30)
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| InChIKey |
HHIARXWMNWOFMV-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