DH1

2,4-DIAMINO-5-[2-METHOXY-5-(4-CARBOXYBUTYLOXY)BENZYL]PYRIMIDINE


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Chemical Component Summary

Name2,4-DIAMINO-5-[2-METHOXY-5-(4-CARBOXYBUTYLOXY)BENZYL]PYRIMIDINE
Identifiers5-[3-[(2,4-diaminopyrimidin-5-yl)methyl]-4-methoxy-phenoxy]pentanoic acid
FormulaC17 H22 N4 O4
Molecular Weight346.381
TypeNON-POLYMER
Isomeric SMILESCOc1ccc(cc1Cc2cnc(nc2N)N)OCCCCC(=O)O
InChIInChI=1S/C17H22N4O4/c1-24-14-6-5-13(25-7-3-2-4-15(22)23)9-11(14)8-12-10-20-17(19)21-16(12)18/h5-6,9-10H,2-4,7-8H2,1H3,(H,22,23)(H4,18,19,20,21)
InChIKeyALDCXILJAYAUTH-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count47
Chiral Atom Count0
Bond Count48
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 490573
ChEMBL CHEMBL37520