2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide
TL;DR: 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide (CAS 898461-84-2) is a chemical compound with molecular formula C18H23N5O2S2 and molecular weight 405.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-(cyclohexylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide
Also Known As: F2680-0494, 2-({5-[(cyclohexylcarbamoyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-(2-methylphenyl)acetamide, 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide, 2-[[5-(cyclohexylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide
| Molecular Formula | C18H23N5O2S2 |
|---|---|
| Molecular Weight | 405.13 g/mol |
| LogP | 4.03152 |
| Topological Polar Surface Area | 96.01 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.1293 |
| Heavy Atoms | 27 |
| Complexity | 789.5641 |
Chemical Identifiers
| CAS Number | 898461-84-2 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CSC2=NN=C(S2)NC(=O)NC3CCCCC3 |
Product Overview
2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide (CAS 898461-84-2), with molecular formula C18H23N5O2S2 and molecular weight 405.13 g/mol. IUPAC: 2-[[5-(cyclohexylcarbamoylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide.
Chemical Property Profile of 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide
Property Insights of 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide
The XLogP value of 4.03152 indicates that 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide. Following Lipinski's Rule of Five, 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide has 3 hydrogen bond donor(s) and 6 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 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide?
The CAS number of 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide is 898461-84-2.
What is the molecular formula of 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide?
The molecular formula of 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide is C18H23N5O2S2.
What is the molecular weight of 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide?
The molecular weight of 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide is 405.13 g/mol.
Where can I buy 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide?
You can request a quote for 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((5-(3-cyclohexylureido)-1,3,4-thiadiazol-2-yl)thio)-N-(o-tolyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.