Chemical Component Summary

Namemethyl 2-bromo-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)benzoate
Identifiersmethyl 2-bromanyl-5-(7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)benzoate
FormulaC14 H11 Br N4 O2
Molecular Weight347.167
TypeNON-POLYMER
Isomeric SMILESCOC(=O)c1cc(ccc1Br)Nc2c3cc[nH]c3ncn2
InChIInChI=1S/C14H11BrN4O2/c1-21-14(20)10-6-8(2-3-11(10)15)19-13-9-4-5-16-12(9)17-7-18-13/h2-7H,1H3,(H2,16,17,18,19)
InChIKeyYHDDNFHODNKNQV-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count32
Chiral Atom Count0
Bond Count34
Aromatic Bond Count16

Related Resource References

Resource NameReference
PubChem 71720884