5-(6-morpholinopyridin-3-ylamino)-7-chloropyrido[4,3-d]pyrimidin-4(3H)-one
Basic information
- Standard SMILES
O=c1[nH]cnc2cc(Cl)nc(Nc3ccc(N4CCOCC4)nc3)c12- InChIKey
ZBJHHARFWZZXRY-UHFFFAOYSA-N- Molecular formula
- C16H15ClN6O2
- Average molar mass
- 358.78 g/mol
Names & identifiers
- Preferred name
- 5-(6-morpholinopyridin-3-ylamino)-7-chloropyrido[4,3-d]pyrimidin-4(3H)-one
- IUPAC
- 7-chloro-5-[(6-morpholin-4-yl-3-pyridinyl)amino]-3H-pyrido[4,3-d]pyrimidin-4-one
Names & synonyms
SCHEMBL1058077ZBJHHARFWZZXRY-UHFFFAOYSA-N5-(6-morpholinopyridin-3-ylamino)-7-chloropyrido[4,3-d]pyrimidin-4(3H)-one
Database identifiers
- PubChem CID
- 136111176
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 91.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 515
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Related reactions
3 records
Compound notes
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