HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

8-Ethoxy-4-morpholino-2-piperazino-pyrimido-[5,4-d]-pyrimidine

HCID 20150293
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOc1ncnc2c(N3CCOCC3)nc(N3CCNCC3)nc12
InChIKey
ZPHKLHGEKPKVQN-UHFFFAOYSA-N
Molecular formula
C16H23N7O2
Average molar mass
345.4 g/mol

Names & identifiers

Preferred name
8-Ethoxy-4-morpholino-2-piperazino-pyrimido-[5,4-d]-pyrimidine
IUPAC
4-(8-ethoxy-2-piperazin-1-ylpyrimido[5,4-d]pyrimidin-4-yl)morpholine

Names & synonyms

SCHEMBL10657925ZPHKLHGEKPKVQN-UHFFFAOYSA-N8-Ethoxy-4-morpholino-2-piperazino-pyrimido-[5,4-d]-pyrimidine

Database identifiers

PubChem CID
20150293

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
88.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
4
Heavy atoms
25
Formal charge
0
Complexity
417

Related reactions

4 records
New reaction record
HRID 98559 reaction equation
HRID 98559As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 462963 reaction equation
HRID 462963As productuspto-grants-1985_05
HRID 568433 reaction equation
HRID 568433As productuspto-grants-1988_03
HRID 2308638 reaction equation
HRID 2308638As productuspto-grants-1987_09

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes