Basic information
- Standard SMILES
COc1ccc(-c2cnc(Cl)cc2NC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1- InChIKey
DWKMZGBWUCXXTN-QGZVFWFLSA-N- Molecular formula
- C22H28ClN3O4
- Average molar mass
- 433.9 g/mol
Names & identifiers
- Preferred name
- (R)-tert-Butyl 2-((2-chloro-5-(4-methoxyphenyl)pyridin-4-ylamino)methyl)morpholine-4-carboxylate
- IUPAC
- tert-butyl (2R)-2-[[[2-chloro-5-(4-methoxyphenyl)-4-pyridinyl]amino]methyl]morpholine-4-carboxylate
Names & synonyms
SCHEMBL620446DWKMZGBWUCXXTN-QGZVFWFLSA-N(R)-tert-Butyl 2-((2-chloro-5-(4-methoxyphenyl)pyridin-4-ylamino)methyl)morpholine-4-carboxylate
Database identifiers
- PubChem CID
- 59613416
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 551
Related reactions
2 records
Compound notes
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