5-(4'-Dimethylamino-5,6-dimethoxy-biphenyl-3-ylmethyl)-pyrimidine-2,4-diamine

HCID 19081683
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1cc(Cc2cnc(N)nc2N)cc(-c2ccc(N(C)C)cc2)c1OC
InChIKey
KXNCJVVCFQZUIS-UHFFFAOYSA-N
Molecular formula
C21H25N5O2
Average molar mass
379.5 g/mol

Names & identifiers

Preferred name
5-(4'-Dimethylamino-5,6-dimethoxy-biphenyl-3-ylmethyl)-pyrimidine-2,4-diamine
IUPAC
5-[[3-[4-(dimethylamino)phenyl]-4,5-dimethoxyphenyl]methyl]pyrimidine-2,4-diamine

Names & synonyms

SCHEMBL7123622KXNCJVVCFQZUIS-UHFFFAOYSA-N5-(4'-dimethylamino-5,6-dimethoxy-biphenyl-3-ylmethyl)-pyrimidine-2,4-diamine

Database identifiers

PubChem CID
19081683

Properties

Computed structural properties

XLogP
3
Topological polar surface area
99.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
28

Related reactions

2 records
New reaction record

Linked notes

Loading…