Chemical Component Summary

Name4-(1H-pyrazol-5-yl)-2-{4-[(3S)-pyrrolidin-3-ylamino]quinazolin-2-yl}phenol
Identifiers4-(2H-pyrazol-3-yl)-2-[4-[[(3S)-pyrrolidin-3-yl]amino]quinazolin-2-yl]phenol
FormulaC21 H20 N6 O
Molecular Weight372.423
TypeNON-POLYMER
Isomeric SMILESc1ccc2c(c1)c(nc(n2)c3cc(ccc3O)c4ccn[nH]4)N[C@H]5CCNC5
InChIInChI=1S/C21H20N6O/c28-19-6-5-13(17-8-10-23-27-17)11-16(19)21-25-18-4-2-1-3-15(18)20(26-21)24-14-7-9-22-12-14/h1-6,8,10-11,14,22,28H,7,9,12H2,(H,23,27)(H,24,25,26)/t14-/m0/s1
InChIKeyDZNFGQDAMCNMLC-AWEZNQCLSA-N

Chemical Details

Formal Charge0
Atom Count48
Chiral Atom Count1
Bond Count52
Aromatic Bond Count24

Related Resource References

Resource NameReference
Pharos CHEMBL1234108
PubChem 135566382
ChEMBL CHEMBL1234108