(2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene

C11H11N3S — CID 14222602

IUPAC(2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene
SMILESCc1nc(C)c(/N=N/c2ccccc2)s1
InChIInChI=1S/C11H11N3S/c1-8-11(15-9(2)12-8)14-13-10-6-4-3-5-7-10/h3-7H,1-2H3/b14-13+
InChIKeyZTUATKLIRHCVAI-BUHFOSPRSA-N
MW217.30 g/mol
LogP4.18
Rot. Bonds2

About (2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene

(2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene (PubChem CID 14222602) has the molecular formula C11H11N3S and a molecular weight of 217.30 g/mol. Its IUPAC name is (2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene.

Molecular Properties

Compound Name(2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene
PubChem CID14222602
Molecular FormulaC11H11N3S
Molecular Weight217.30 g/mol
Exact Mass217.07
IUPAC Name(2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene
SMILESCc1nc(C)c(/N=N/c2ccccc2)s1
InChIInChI=1S/C11H11N3S/c1-8-11(15-9(2)12-8)14-13-10-6-4-3-5-7-10/h3-7H,1-2H3/b14-13+
InChIKeyZTUATKLIRHCVAI-BUHFOSPRSA-N
XLogP4.18
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.30
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

diphenyldiazene;hydrofluoride
CID 174857584
(2E)-N-(4-chloroanilino)-4-methyl-5-phenyldiazenyl-1,3-thiazole-2-carboximidoyl cyanide
CID 135482844
bis(diphenyldiazene);uranium;vanadium
CID 158886927
(5-isocyano-2-methyl-1H-imidazol-4-yl)-phenyldiazene
CID 135733604
2,4-dimethyl-5-phenyl-1,3-thiazole;fluoroform
CID 159404933
4-methyl-N-[4-methyl-5-[(E)-C-methyl-N-[(4-methyl-5-phenyldiazenyl-1,3-thiazol-2-yl)amino]carbonimidoyl]-1,3-thiazol-2-yl]benzenesulfonamide
CID 177496713
5-bromo-2-methyl-4-phenyl-1,3-thiazole
CID 3613557
5-chloro-2,4-dimethyl-1,3-thiazole
CID 20719823
phenyl-(1-phenyl-[1,3]thiazolo[3,2-a]benzimidazol-2-yl)diazene
CID 14906114
5-[2-(diethylamino)-5-phenyldiazenyl-1,3-thiazol-4-yl]-2-N,2-N-diethyl-1,3-thiazole-2,4-diamine
CID 135423915
2-phenyldiazenylthieno[2,3-b]pyridin-3-ol
CID 137227991
5-bromo-4-methyl-2-[(E)-3-phenylprop-1-enyl]-1,3-thiazole
CID 169260165

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene?
The IUPAC name of (2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene (CID 14222602) is (2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene.
What is the SMILES notation for (2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene?
The canonical SMILES for (2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene is Cc1nc(C)c(/N=N/c2ccccc2)s1.
What is the InChIKey of (2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene?
The InChIKey is ZTUATKLIRHCVAI-BUHFOSPRSA-N. The full InChI is InChI=1S/C11H11N3S/c1-8-11(15-9(2)12-8)14-13-10-6-4-3-5-7-10/h3-7H,1-2H3/b14-13+.
What are the key properties of (2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene?
(2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene has a molecular weight of 217.30 g/mol, XLogP of 4.18, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethyl-1,3-thiazol-5-yl)-phenyldiazene is sourced from PubChem (CID 14222602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).