3-[2-(6-Methoxy-pyridin-3-ylamino)-4-phenylamino-pyrimidin-5-yl]-2-(4-methoxy-phenyl)-propionic acid methyl ester

HCID 21044318

Basic information

Standard SMILES
COC(=O)C(Cc1cnc(Nc2ccc(OC)nc2)nc1Nc1ccccc1)c1ccc(OC)cc1
InChIKey
AKABDZICYIWPDV-UHFFFAOYSA-N
Molecular formula
C27H27N5O4
Average molar mass
485.5 g/mol

Names & identifiers

Preferred name
3-[2-(6-Methoxy-pyridin-3-ylamino)-4-phenylamino-pyrimidin-5-yl]-2-(4-methoxy-phenyl)-propionic acid methyl ester
IUPAC
methyl 3-[4-anilino-2-[(6-methoxy-3-pyridinyl)amino]pyrimidin-5-yl]-2-(4-methoxyphenyl)propanoate

Names & synonyms

SCHEMBL4766654AKABDZICYIWPDV-UHFFFAOYSA-N3-[2-(6-methoxy-pyridin-3-ylamino)-4-phenylamino-pyrimidin-5-yl]-2-(4-methoxy-phenyl)-propionic acid methyl ester

Database identifiers

PubChem CID
21044318

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
107 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
11
Heavy atoms
36

Related reactions

4 records

Linked notes

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