N'-{[7-(cyclopentylamino)-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridin-3-yl]-2-pyrimidinyl}-1,3-benzenediamine

HCID 10141279

Basic information

Standard SMILES
COc1ccc(-c2nn3c(NC4CCCC4)cccc3c2-c2ccnc(Nc3cccc(N)c3)n2)cc1
InChIKey
KPRKTJOXMKNORT-UHFFFAOYSA-N
Molecular formula
C29H29N7O
Average molar mass
491.6 g/mol

Names & identifiers

Preferred name
N'-{[7-(cyclopentylamino)-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridin-3-yl]-2-pyrimidinyl}-1,3-benzenediamine
IUPAC
3-N-[4-[7-(cyclopentylamino)-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridin-3-yl]pyrimidin-2-yl]benzene-1,3-diamine

Names & synonyms

SCHEMBL6338970KPRKTJOXMKNORT-UHFFFAOYSA-NN'-{[7-(cyclopentylamino)-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridin-3-yl]-2-pyrimidinyl}-1,3-benzenediamineN'-{4-[7-(Cyclopentylamino)-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyridin-3-yl]-2-pyrimidinyl}-1,3-benzenediamineN'-{4-[7-(cyclopentylamino)-2-(4-methoxyphenyl)pyrazolo[1,5-alpha]pyridin-3-yl]-2-pyrimidinyl}-1,3-benzenediamine

Database identifiers

PubChem CID
10141279

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
102 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
7
Rotatable bonds
7
Heavy atoms
37

Related reactions

4 records

Compound notes

Loading…