N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine

C11H10N4S — CID 116829136

IUPACN-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
SMILESCNc1nc2scc(-c3ccccc3)n2n1
InChIInChI=1S/C11H10N4S/c1-12-10-13-11-15(14-10)9(7-16-11)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,14)
InChIKeySXSIAYXQGSDZND-UHFFFAOYSA-N
MW230.30 g/mol
LogP2.50
Rot. Bonds2

About N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine

N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine (PubChem CID 116829136) has the molecular formula C11H10N4S and a molecular weight of 230.30 g/mol. Its IUPAC name is N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine.

Molecular Properties

Compound NameN-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
PubChem CID116829136
Molecular FormulaC11H10N4S
Molecular Weight230.30 g/mol
Exact Mass230.06
IUPAC NameN-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
SMILESCNc1nc2scc(-c3ccccc3)n2n1
InChIInChI=1S/C11H10N4S/c1-12-10-13-11-15(14-10)9(7-16-11)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,14)
InChIKeySXSIAYXQGSDZND-UHFFFAOYSA-N
XLogP2.50
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.30
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-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

N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)benzenesulfonamide
CID 108780564
N-(5-methyl-1,3,4-thiadiazol-2-yl)-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
CID 108772214
4-phenyl-N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)benzamide
CID 108751770
3-chloro-2,2-dimethyl-N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide
CID 108751761
N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)butane-1-sulfonamide
CID 108780563
N-[2-methyl-6-(4-methylphenyl)pyrimidin-4-yl]-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
CID 108772231
2-methylpropyl N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)carbamate
CID 108727855
4-methyl-3,5-dinitro-N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)benzamide
CID 108727829
2-(2,6-dimethyl-4-oxo-1-pyridinyl)-N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)acetamide
CID 108811515
N-(6-chloro-2-ethylpyrimidin-4-yl)-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine
CID 108772258
N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)-3,5-bis(trifluoromethyl)benzamide
CID 108751894
3-methyl-N-(6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)-1-benzofuran-2-carboxamide
CID 108811403

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
The IUPAC name of N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine (CID 116829136) is N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine.
What is the SMILES notation for N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
The canonical SMILES for N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine is CNc1nc2scc(-c3ccccc3)n2n1.
What is the InChIKey of N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
The InChIKey is SXSIAYXQGSDZND-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4S/c1-12-10-13-11-15(14-10)9(7-16-11)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,14).
What are the key properties of N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine?
N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine has a molecular weight of 230.30 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-phenyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-amine is sourced from PubChem (CID 116829136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).