UEX

6-chloranyl-3-[[(1R)-1-[2-(1,3-dihydropyrrolo[3,4-c]pyridin-2-yl)-3,6-dimethyl-4-oxidanylidene-quinazolin-8-yl]ethyl]amino]pyridine-2-carboxylic acid


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Chemical Component Summary

Name6-chloranyl-3-[[(1R)-1-[2-(1,3-dihydropyrrolo[3,4-c]pyridin-2-yl)-3,6-dimethyl-4-oxidanylidene-quinazolin-8-yl]ethyl]amino]pyridine-2-carboxylic acid
Identifiers6-chloranyl-3-[[(1~{R})-1-[2-(1,3-dihydropyrrolo[3,4-c]pyridin-2-yl)-3,6-dimethyl-4-oxidanylidene-quinazolin-8-yl]ethyl]amino]pyridine-2-carboxylic acid
FormulaC25 H23 Cl N6 O3
Molecular Weight490.942
TypeNON-POLYMER
Isomeric SMILESCc1cc2c(c(c1)[C@@H](C)Nc3ccc(nc3C(=O)O)Cl)N=C(N(C2=O)C)N4Cc5ccncc5C4
InChIInChI=1S/C25H23ClN6O3/c1-13-8-17(14(2)28-19-4-5-20(26)29-22(19)24(34)35)21-18(9-13)23(33)31(3)25(30-21)32-11-15-6-7-27-10-16(15)12-32/h4-10,14,28H,11-12H2,1-3H3,(H,34,35)/t14-/m1/s1
InChIKeyNTAJKWXFTUHESI-CQSZACIVSA-N

Chemical Details

Formal Charge0
Atom Count58
Chiral Atom Count1
Bond Count62
Aromatic Bond Count18

Related Resource References

Resource NameReference
PubChem 171121786