4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide

C19H19N3O2S — CID 100746505

IUPAC4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide
SMILESCOc1ccc(-c2nnsc2C(=O)Nc2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C19H19N3O2S/c1-11-9-12(2)16(13(3)10-11)20-19(23)18-17(21-22-25-18)14-5-7-15(24-4)8-6-14/h5-10H,1-4H3,(H,20,23)
InChIKeyZAYKYIINQAAMRP-UHFFFAOYSA-N
MW353.45 g/mol
LogP4.39
Rot. Bonds4

About 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide

4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide (PubChem CID 100746505) has the molecular formula C19H19N3O2S and a molecular weight of 353.45 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide
PubChem CID100746505
Molecular FormulaC19H19N3O2S
Molecular Weight353.45 g/mol
Exact Mass353.12
IUPAC Name4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide
SMILESCOc1ccc(-c2nnsc2C(=O)Nc2c(C)cc(C)cc2C)cc1
InChIInChI=1S/C19H19N3O2S/c1-11-9-12(2)16(13(3)10-11)20-19(23)18-17(21-22-25-18)14-5-7-15(24-4)8-6-14/h5-10H,1-4H3,(H,20,23)
InChIKeyZAYKYIINQAAMRP-UHFFFAOYSA-N
XLogP4.39
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.45
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-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

N-(2,5-dimethoxyphenyl)-4-(4-methylphenyl)thiadiazole-5-carboxamide
CID 100748871
N-[(4-methoxyphenyl)methyl]-4-(4-methylphenyl)thiadiazole-5-carboxamide
CID 100748562
4-(4-bromophenyl)-N-(2,6-dimethylphenyl)thiadiazole-5-carboxamide
CID 100750600
4-(4-methoxyphenyl)thiadiazole-5-carboxylic acid
CID 28948361
N-cyclopropyl-4-(4-methoxyphenyl)thiadiazole-5-carboxamide
CID 45495603
N-(1H-indol-5-yl)-4-(4-methoxyphenyl)thiadiazole-5-carboxamide
CID 45492112
N-(3-methylphenyl)-4-(4-methylphenyl)thiadiazole-5-carboxamide
CID 100748644
methyl (2S)-2-[[4-(4-methoxyphenyl)thiadiazole-5-carbonyl]amino]-3-methylbutanoate
CID 45495391
4-(4-methoxyphenyl)-N-[[(2R)-oxolan-2-yl]methyl]thiadiazole-5-carboxamide
CID 51718226
methyl 2-[[4-(4-methylphenyl)thiadiazole-5-carbonyl]amino]benzoate
CID 100748907
N-[4-(1-cyanocyclopropyl)phenyl]-4-(4-methoxyphenyl)thiadiazole-5-carboxamide
CID 100775097
4-(4-methoxyphenyl)-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)thiadiazole-5-carboxamide
CID 52900445

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide?
The IUPAC name of 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide (CID 100746505) is 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide.
What is the SMILES notation for 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide?
The canonical SMILES for 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide is COc1ccc(-c2nnsc2C(=O)Nc2c(C)cc(C)cc2C)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide?
The InChIKey is ZAYKYIINQAAMRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2S/c1-11-9-12(2)16(13(3)10-11)20-19(23)18-17(21-22-25-18)14-5-7-15(24-4)8-6-14/h5-10H,1-4H3,(H,20,23).
What are the key properties of 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide?
4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide has a molecular weight of 353.45 g/mol, XLogP of 4.39, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-N-(2,4,6-trimethylphenyl)thiadiazole-5-carboxamide is sourced from PubChem (CID 100746505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).