Chemical Compound

Stacofylline

CAS Registry Number98833-92-2
Stacofylline chemical structure
Primary record

Stacofylline

CAS
98833-92-2
PubChem CID
132157
SMILES
CCN(CC)C(=O)N1CCN(CC1)CCCC2=NC3=C(N2C)C(=O)N(C(=O)N3C)C
Molecular Formula
C20H33N7O3
Molecular Weight
419.53
Exact Mass
419.2645
InChI
InChI=1S/C20H33N7O3/c1-6-26(7-2)20(30)27-13-11-25(12-14-27)10-8-9-15-21-17-16(22(15)3)18(28)24(5)19(29)23(17)4/h6-14H2,1-5H3
InChIKey
PKXWXHGLEXOSQK-UHFFFAOYSA-N
LogP
-0.0173
TPSA
88.61

Names and synonyms

  • Stacofylline
  • estacofilina
  • stacofyllinum
  • Stacofylline [INN]
  • C7K8PK4Q0E
  • UNII-C7K8PK4Q0E
  • AC1Q6KAE
  • RefChem:185303
  • 98833-92-2
  • AC1L30I1
  • orb1745179
  • SCHEMBL8091923
  • CHEMBL2107536
  • DTXSID90869325
  • AR-1K2042
  • CID132157
  • TS-09540
  • S-9977
  • HY-106412
  • J457.023E
  • CS-0025752
  • Q27275297
  • n,n-diethyl-4-[3-(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1h-purin-8-yl)propyl]piperazine-1-carboxamide
  • N,N-diethyl-4-[3-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)propyl]piperazine-1-carboxamide
  • 1-Piperazinecarboxamide, N,N-diethyl-4-(3-(2,3,6,7-tetrahydro-1,3,7-trimethyl-2,4-dioxo-1H-purin-8-yl)propyl)-
  • N,N-Diethyl-4-(3-(1,2,3,6-tetrahydro-1,3,7-trimethyl-2,6-dioxopurin-8-yl)propyl)-1-piperazinecarboxamide
  • 1,3,7-Trimethyl-8-[3-[4-(diethylaminocarbonyl)piperazin-1-yl]propyl]-7H-purine-2,6(1H,3H)-dione
  • 106710-46-7
  • N,N-Diethyl-4-[3-[(1,3,7-trimethyl-2,3,6,7-tetrahydro-2,6-dioxo-1H-purin)-8-yl]propyl]piperazine-1-carboxamide