6-(4-{5-[(3-Chlorophenyl)amino]-1,3,4-oxadiazol-2-yl}phenoxy) pyrimidine-2,4-diamine

HCID 11610937

Basic information

Standard SMILES
Nc1cc(Oc2ccc(-c3nnc(Nc4cccc(Cl)c4)o3)cc2)nc(N)n1
InChIKey
VEUXPKVMHIPHAI-UHFFFAOYSA-N
Molecular formula
C18H14ClN7O2
Average molar mass
395.8 g/mol

Names & identifiers

Preferred name
6-(4-{5-[(3-Chlorophenyl)amino]-1,3,4-oxadiazol-2-yl}phenoxy) pyrimidine-2,4-diamine
IUPAC
6-[4-[5-(3-chloroanilino)-1,3,4-oxadiazol-2-yl]phenoxy]pyrimidine-2,4-diamine

Names & synonyms

SCHEMBL3531460VEUXPKVMHIPHAI-UHFFFAOYSA-N6-(4-{5-[(3-chlorophenyl)amino]-1,3,4-oxadiazol-2-yl}phenoxy) pyrimidine-2,4-diamine6-(4-{5-[(3-chlorophenyl)amino]-1,3,4-oxadiazol-2-yl}phenoxy)pyrimidine-2,4-diamine

Database identifiers

PubChem CID
11610937

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
138 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
9
Rotatable bonds
5
Heavy atoms
28

Related reactions

4 records

Compound notes

Loading…