Ethanesulfonic acid [6-[2-(5-methylsulfanyl-pyrimidin-2-yloxy)-ethoxy]-5-(2-methoxy-phenoxy)-[2,2']bipyrimidinyl-4-yl]-amide

HCID 59645276
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Basic information

Standard SMILES
CCS(=O)(=O)Nc1nc(-c2ncccn2)nc(OCCOc2ncc(SC)cn2)c1Oc1ccccc1OC
InChIKey
OHIYBHBEYDPXSX-UHFFFAOYSA-N
Molecular formula
C24H25N7O6S2
Average molar mass
571.6 g/mol

Names & identifiers

Preferred name
Ethanesulfonic acid [6-[2-(5-methylsulfanyl-pyrimidin-2-yloxy)-ethoxy]-5-(2-methoxy-phenoxy)-[2,2']bipyrimidinyl-4-yl]-amide
IUPAC
N-[5-(2-methoxyphenoxy)-6-[2-(5-methylsulfanylpyrimidin-2-yl)oxyethoxy]-2-pyrimidin-2-ylpyrimidin-4-yl]ethanesulfonamide

Names & synonyms

SCHEMBL14289224OHIYBHBEYDPXSX-UHFFFAOYSA-Nethanesulfonic acid [6-[2-(5-methylsulfanyl-pyrimidin-2-yloxy)-ethoxy]-5-(2-methoxy-phenoxy)-[2,2']bipyrimidinyl-4-yl]-amide

Database identifiers

PubChem CID
59645276

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
194 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
14
Rotatable bonds
13
Heavy atoms
39

Related reactions

2 records
New reaction record

Compound notes

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