3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine

C17H14Cl2N6S — CID 24674286

IUPAC3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine
SMILESCc1cccn2cc(CSc3nnc(-c4ccc(Cl)cc4Cl)n3N)nc12
InChIInChI=1S/C17H14Cl2N6S/c1-10-3-2-6-24-8-12(21-15(10)24)9-26-17-23-22-16(25(17)20)13-5-4-11(18)7-14(13)19/h2-8H,9,20H2,1H3
InChIKeyDZDUETPFWLDWBV-UHFFFAOYSA-N
MW405.31 g/mol
LogP4.21
Rot. Bonds4

About 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine

3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine (PubChem CID 24674286) has the molecular formula C17H14Cl2N6S and a molecular weight of 405.31 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine
PubChem CID24674286
Molecular FormulaC17H14Cl2N6S
Molecular Weight405.31 g/mol
Exact Mass404.04
IUPAC Name3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine
SMILESCc1cccn2cc(CSc3nnc(-c4ccc(Cl)cc4Cl)n3N)nc12
InChIInChI=1S/C17H14Cl2N6S/c1-10-3-2-6-24-8-12(21-15(10)24)9-26-17-23-22-16(25(17)20)13-5-4-11(18)7-14(13)19/h2-8H,9,20H2,1H3
InChIKeyDZDUETPFWLDWBV-UHFFFAOYSA-N
XLogP4.21
TPSA74.03 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.31
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2-chlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine
CID 24674294
3-(2-chlorophenyl)-5-(imidazo[1,2-a]pyridin-2-ylmethylsulfanyl)-1,2,4-triazol-4-amine
CID 7171227
3-[(6-chloroimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-5-(2-chlorophenyl)-1,2,4-triazol-4-amine
CID 84601588
2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-8-methylimidazo[1,2-a]pyridine
CID 78763238
2-[[5-(2-fluorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]-8-methylimidazo[1,2-a]pyridine
CID 112784428
8-methyl-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]imidazo[1,2-a]pyridine
CID 40663459
2-[[4-amino-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)acetamide
CID 2588208
4-[[4-amino-5-(2,4-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-7,8-dimethylchromen-2-one
CID 3654323
5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,3-thiazol-2-amine
CID 43250010
2-[(1-cyclohexyltetrazol-5-yl)sulfanylmethyl]-8-methylimidazo[1,2-a]pyridine
CID 17458002
2-[(3-chlorophenyl)methyl]-8-methylimidazo[1,2-a]pyridine
CID 117137235
2-methyl-3-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]aniline
CID 79143687

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine?
The IUPAC name of 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine (CID 24674286) is 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine?
The canonical SMILES for 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine is Cc1cccn2cc(CSc3nnc(-c4ccc(Cl)cc4Cl)n3N)nc12.
What is the InChIKey of 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine?
The InChIKey is DZDUETPFWLDWBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14Cl2N6S/c1-10-3-2-6-24-8-12(21-15(10)24)9-26-17-23-22-16(25(17)20)13-5-4-11(18)7-14(13)19/h2-8H,9,20H2,1H3.
What are the key properties of 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine?
3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine has a molecular weight of 405.31 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-5-[(8-methylimidazo[1,2-a]pyridin-2-yl)methylsulfanyl]-1,2,4-triazol-4-amine is sourced from PubChem (CID 24674286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).