Chemical Component Summary

NameN-[3-(4-amino-6-{[4-(morpholine-4-carbonyl)phenyl]amino}-1,3,5-triazin-2-yl)-2-methylphenyl]-4-tert-butylbenzamide
Identifiers~{N}-[3-[4-azanyl-6-[(4-morpholin-4-ylcarbonylphenyl)amino]-1,3,5-triazin-2-yl]-2-methyl-phenyl]-4-~{tert}-butyl-benzamide
FormulaC32 H35 N7 O3
Molecular Weight565.665
TypeNON-POLYMER
Isomeric SMILESCc1c(cccc1NC(=O)c2ccc(cc2)C(C)(C)C)c3nc(nc(n3)Nc4ccc(cc4)C(=O)N5CCOCC5)N
InChIInChI=1S/C32H35N7O3/c1-20-25(6-5-7-26(20)35-28(40)21-8-12-23(13-9-21)32(2,3)4)27-36-30(33)38-31(37-27)34-24-14-10-22(11-15-24)29(41)39-16-18-42-19-17-39/h5-15H,16-19H2,1-4H3,(H,35,40)(H3,33,34,36,37,38)
InChIKeyBRQYZNVVGDQNTM-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count77
Chiral Atom Count0
Bond Count81
Aromatic Bond Count24

Related Resource References

Resource NameReference
Pharos CHEMBL4209148
PubChem 71721544
ChEMBL CHEMBL4209148