(S)-tert-Butyl 2-((2-chloro-5-(4-methoxyphenyl)pyridin-4-ylamino)methyl)morpholine-4-carboxylate

HCID 59613477
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Basic information

Standard SMILES
COc1ccc(-c2cnc(Cl)cc2NC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1
InChIKey
DWKMZGBWUCXXTN-KRWDZBQOSA-N
Molecular formula
C22H28ClN3O4
Average molar mass
433.9 g/mol
Monoisotopic mass
433.1768341

Names & identifiers

Preferred name
(S)-tert-Butyl 2-((2-chloro-5-(4-methoxyphenyl)pyridin-4-ylamino)methyl)morpholine-4-carboxylate
IUPAC
tert-butyl (2S)-2-[[[2-chloro-5-(4-methoxyphenyl)-4-pyridinyl]amino]methyl]morpholine-4-carboxylate

Names & synonyms

SCHEMBL621193DWKMZGBWUCXXTN-KRWDZBQOSA-N(S)-tert-Butyl 2-((2-chloro-5-(4-methoxyphenyl)pyridin-4-ylamino)methyl)morpholine-4-carboxylate

Database identifiers

PubChem CID
59613477

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

Related reactions

2 records
New reaction record

Compound notes

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