N-Cyclopropyl-4-methoxy-2,6-dimethyl-N-(2-(6-(9-(pyridin-4-yl)-3,9-diazaspiro[5.5]undecan-3-yl)pyrimidin-4-yloxy)ethyl)benzenesulfonamide

HCID 46207142
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Basic information

Standard SMILES
COc1cc(C)c(S(=O)(=O)N(CCOc2cc(N3CCC4(CCN(c5ccncc5)CC4)CC3)ncn2)C2CC2)c(C)c1
InChIKey
MDHAYHHJQPPLLJ-UHFFFAOYSA-N
Molecular formula
C32H42N6O4S
Average molar mass
606.8 g/mol

Names & identifiers

Preferred name
N-Cyclopropyl-4-methoxy-2,6-dimethyl-N-(2-(6-(9-(pyridin-4-yl)-3,9-diazaspiro[5.5]undecan-3-yl)pyrimidin-4-yloxy)ethyl)benzenesulfonamide
IUPAC
N-cyclopropyl-4-methoxy-2,6-dimethyl-N-[2-[6-(9-pyridin-4-yl-3,9-diazaspiro[5.5]undecan-3-yl)pyrimidin-4-yl]oxyethyl]benzenesulfonamide

Names & synonyms

SCHEMBL2361808MDHAYHHJQPPLLJ-UHFFFAOYSA-NN-Cyclopropyl-4-methoxy-2,6-dimethyl-N-(2-(6-(9-(pyridin-4-yl)-3,9-diazaspiro[5.5]undecan-3-yl)pyrimidin-4-yloxy)ethyl)benzenesulfonamide

Database identifiers

PubChem CID
46207142

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
109 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
10
Rotatable bonds
10
Heavy atoms
43

Related reactions

2 records
New reaction record

Compound notes

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N-Cyclopropyl-4-methoxy-2,6-dimethyl-N-(2-(6-(9-(pyridin-4-yl)-3,9-diazaspiro[5.5]undecan-3-yl)pyrimidin-4-yloxy)ethyl)benzenesulfonamide (HCID 46207142)｜Huagongshe