N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide
TL;DR: N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide (CAS 606102-01-6) is a chemical compound with molecular formula C11H11N3OS and molecular weight 233.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-methylphenyl)methyl]thiadiazole-4-carboxamide
Also Known As: ASN 06744206, N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide, N-[(4-methylphenyl)methyl]thiadiazole-4-carboxamide, 1,2,3-thiadiazole-4-carboxamide,n-[(4-methylphenyl)methyl]-, [1,2,3]Thiadiazole-4-carboxylic acid 4-methyl-benzylamide
| Molecular Formula | C11H11N3OS |
|---|---|
| Molecular Weight | 233.06 g/mol |
| LogP | 1.77652 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.06229 |
| Heavy Atoms | 16 |
| Complexity | 464.4847 |
Chemical Identifiers
| CAS Number | 606102-01-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)C2=CSN=N2 |
Product Overview
N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide (CAS 606102-01-6), with molecular formula C11H11N3OS and molecular weight 233.06 g/mol. IUPAC: N-[(4-methylphenyl)methyl]thiadiazole-4-carboxamide.
Chemical Property Profile of N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide
Property Insights of N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide
The XLogP value of 1.77652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide. With a topological polar surface area (TPSA) of 54.88 Ų, N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide?
The CAS number of N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide is 606102-01-6.
What is the molecular formula of N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide?
The molecular formula of N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide is C11H11N3OS.
What is the molecular weight of N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide?
The molecular weight of N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide is 233.06 g/mol.
Where can I buy N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide?
You can request a quote for N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-methylbenzyl)-1,2,3-thiadiazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.