N-(4-(2,4-Dimethyl-thiazol-5-YL)-pyrimidin-2-YL)-N',N'-dimethyl-benzene-1,4-diamine

HCID 447962

Basic information

Standard SMILES
Cc1nc(C)c(-c2ccnc(Nc3ccc(N(C)C)cc3)n2)s1
InChIKey
FGGSNQOBRJVAKL-UHFFFAOYSA-N
Molecular formula
C17H19N5S
Average molar mass
325.4 g/mol

Names & identifiers

Preferred name
N-(4-(2,4-Dimethyl-thiazol-5-YL)-pyrimidin-2-YL)-N',N'-dimethyl-benzene-1,4-diamine
IUPAC
1-N-[4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]-4-N,4-N-dimethylbenzene-1,4-diamine

Names & synonyms

N-[4-(2,4-DIMETHYL-THIAZOL-5-YL)-PYRIMIDIN-2-YL]-N',N'-DIMETHYL-BENZENE-1,4-DIAMINEN-(4-(2,4-Dimethyl-thiazol-5-YL)-pyrimidin-2-YL)-N',N'-dimethyl-benzene-1,4-diamineN4-(4-(dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl)-N1,N1-dimethylbenzene-1,4-diamineN4-[4-(dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]-n1,n1-dimethylbenzene-1,4-diamineRefChem:826865CK81pxpn,n-dimethyl-n'-[4-(2,4-dimethyl-thiazol-5-yl)-pyrimidin-2-yl]-benzene-1,4-diaminen,n-dimethyl-n'-{4-(2,4-dimethyl-thiazol-5-yl)-pyrimidin-2-yl}-benzene-1,4-diamine2c5nCHEMBL46817BDBM8066
Show more names
SCHEMBL4799735FGGSNQOBRJVAKL-UHFFFAOYSA-NDB07562PD005071NS000687792-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 37Q270967814-(dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]-1-N,1-N-dimethylbenzene-1,4-diamine, 3

Database identifiers

PubChem CID
447962
ChEMBL
CHEMBL46817
Nikkaji
J2.869.744I

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
82.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
23

Experimental & physicochemical properties

DrugsPharmaceuticals -> Listed in ZINC15

Related reactions

4 records

Compound notes

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