4-Piperidinol, 1-((2-(7-chloro-1,8-naphthyridin-2-yl)-2,3-dihydro-3-oxo-1H-isoindol-1-yl)acetyl)-, propanoate (ester)
Basic information
- CAS
103255-81-8- Standard SMILES
CCC(=O)OC1CCN(C(=O)CC2c3ccccc3C(=O)N2c2ccc3ccc(Cl)nc3n2)CC1- InChIKey
ZAOUYBYLDDGGSY-UHFFFAOYSA-N- Molecular formula
- C26H25ClN4O4
- Average molar mass
- 493 g/mol
- Monoisotopic mass
- 492.156433
Names & identifiers
- Preferred name
- 4-Piperidinol, 1-((2-(7-chloro-1,8-naphthyridin-2-yl)-2,3-dihydro-3-oxo-1H-isoindol-1-yl)acetyl)-, propanoate (ester)
- IUPAC
- [1-[2-[2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-1H-isoindol-1-yl]acetyl]piperidin-4-yl] propanoate
Names & synonyms
103255-81-84-Piperidinol, 1-((2-(7-chloro-1,8-naphthyridin-2-yl)-2,3-dihydro-3-oxo-1H-isoindol-1-yl)acetyl)-, propanoate (ester)RefChem:295688DTXSID209082961-{[2-(7-Chloro-1,8-naphthyridin-2-yl)-3-oxo-2,3-dihydro-1H-isoindol-1-yl]acetyl}piperidin-4-yl propanoate
Database identifiers
- CAS
103255-81-8- PubChem CID
- 13655944
- DTXSID
DTXSID20908296
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 92.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 804
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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