N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide

C19H18N4O2S — CID 7287063

IUPACN-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide
SMILESCc1ccc(-c2nc3sc(CCNC(=O)c4ccco4)c(C)n3n2)cc1
InChIInChI=1S/C19H18N4O2S/c1-12-5-7-14(8-6-12)17-21-19-23(22-17)13(2)16(26-19)9-10-20-18(24)15-4-3-11-25-15/h3-8,11H,9-10H2,1-2H3,(H,20,24)
InChIKeyKEAXDHZDXQWFDG-UHFFFAOYSA-N
MW366.45 g/mol
LogP3.64
Rot. Bonds5

About N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide

N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide (PubChem CID 7287063) has the molecular formula C19H18N4O2S and a molecular weight of 366.45 g/mol. Its IUPAC name is N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide
PubChem CID7287063
Molecular FormulaC19H18N4O2S
Molecular Weight366.45 g/mol
Exact Mass366.12
IUPAC NameN-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide
SMILESCc1ccc(-c2nc3sc(CCNC(=O)c4ccco4)c(C)n3n2)cc1
InChIInChI=1S/C19H18N4O2S/c1-12-5-7-14(8-6-12)17-21-19-23(22-17)13(2)16(26-19)9-10-20-18(24)15-4-3-11-25-15/h3-8,11H,9-10H2,1-2H3,(H,20,24)
InChIKeyKEAXDHZDXQWFDG-UHFFFAOYSA-N
XLogP3.64
TPSA72.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.45
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide 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

Furan-2-carboxylic acid[5-(2-ethyl-2H-tetrazol-5-yl)-4-phenyl-thiazol-2-yl]-amide
CID 11632013
N-[4-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]furan-2-carboxamide
CID 653799
N-(2-furylmethyl)-2-[(5-phenyl[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl)thio]acetamide
CID 1179266
N-(2-furylmethyl)-2-{[5-(4-methylphenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]thio}acetamide
CID 1179302
Furan-2-yl(4-((6-hydroxy-2-methylthiazolo[3,2-b][1,2,4]triazol-5-yl)(phenyl)methyl)piperazin-1-yl)methanone
CID 3236038
Furan-2-yl(4-((6-hydroxy-2-methylthiazolo[3,2-b][1,2,4]triazol-5-yl)(p-tolyl)methyl)piperazin-1-yl)methanone
CID 3244275
5-bromo-N-(2-(2-(3-fluorophenyl)thiazolo[3,2-b][1,2,4]triazol-6-yl)ethyl)furan-2-carboxamide
CID 16028741
5-Bromo-N-{2-[6-methyl-2-(4-methylphenyl)-[1,2,4]triazolo[3,2-B][1,3]thiazol-5-YL]ethyl}furan-2-carboxamide
CID 16032749
4-Tert-butyl-N-{2-[2-(4-methoxyphenyl)-6-methyl-[1,2,4]triazolo[3,2-B][1,3]thiazol-5-YL]ethyl}benzamide
CID 16032765
5-Bromo-N-{2-[2-(4-chlorophenyl)-6-methyl-[1,2,4]triazolo[3,2-B][1,3]thiazol-5-YL]ethyl}furan-2-carboxamide
CID 16032786
N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-4-phenyl-1,3-thiazol-2-yl]furan-2-carboxamide
CID 49864677
N-[5-(1,2,4-oxadiazol-3-yl)-4-phenyl-1,3-thiazol-2-yl]furan-2-carboxamide
CID 49864730

Frequently Asked Questions

What is the IUPAC name of N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide (CID 7287063) is N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide is Cc1ccc(-c2nc3sc(CCNC(=O)c4ccco4)c(C)n3n2)cc1.
What is the InChIKey of N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide?
The InChIKey is KEAXDHZDXQWFDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2S/c1-12-5-7-14(8-6-12)17-21-19-23(22-17)13(2)16(26-19)9-10-20-18(24)15-4-3-11-25-15/h3-8,11H,9-10H2,1-2H3,(H,20,24).
What are the key properties of N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide?
N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide has a molecular weight of 366.45 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[6-methyl-2-(4-methylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl]ethyl]furan-2-carboxamide is sourced from PubChem (CID 7287063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).