DZO

3-(3-aminophenyl)-N-(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-5-amine

Created:2008-08-20
Last modified:  2011-06-04

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Chemical Details

Formal Charge0
Atom Count38
Chiral Atom Count0
Bond Count41
Aromatic Bond Count23
2D diagram of DZO

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Chemical Component Summary

Name3-(3-aminophenyl)-N-(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-5-amine
Systematic Name (OpenEye OEToolkits)3-(3-aminophenyl)-N-(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-5-amine
FormulaC18 H14 Cl N5
Molecular Weight335.79
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Clc1cccc(c1)Nc2nc3c(cnn3cc2)c4cccc(N)c4
SMILESCACTVS3.341Nc1cccc(c1)c2cnn3ccc(Nc4cccc(Cl)c4)nc23
SMILESOpenEye OEToolkits1.5.0c1cc(cc(c1)N)c2cnn3c2nc(cc3)Nc4cccc(c4)Cl
Canonical SMILESCACTVS3.341 Nc1cccc(c1)c2cnn3ccc(Nc4cccc(Cl)c4)nc23
Canonical SMILESOpenEye OEToolkits1.5.0 c1cc(cc(c1)N)c2cnn3c2nc(cc3)Nc4cccc(c4)Cl
InChIInChI1.03 InChI=1S/C18H14ClN5/c19-13-4-2-6-15(10-13)22-17-7-8-24-18(23-17)16(11-21-24)12-3-1-5-14(20)9-12/h1-11H,20H2,(H,22,23)
InChIKeyInChI1.03 JDNMRPIWJIDDAY-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB07698 
Name3-(3-aminophenyl)-N-(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-5-amine
Groups experimental
Synonyms3-(3-aminophenyl)-N-(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-5-amine

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Serine/threonine-protein kinase haspinMAASLPGPGSRLFRTYGAADGRRQRRPGREAAQWFPPQDRRRFFNSSGSS...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 6419789