![1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea structure](/static/products/489/489440-91-7.png)
1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea
TL;DR: 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea (CAS 489440-91-7) is a chemical compound with molecular formula C14H16ClN5OS4 and molecular weight 432.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea
Also Known As: 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea, 2-(2-((5-((2-chlorobenzyl)thio)-1,3,4-thiadiazol-2-yl)thio)acetyl)-N-ethylhydrazinecarbothioamide, 2-[({5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]-N-ethylhydrazinecarbothioamide, 2-{5-[(2-chlorophenyl)methylthio](1,3,4-thiadiazol-2-ylthio)}-N-{[(ethylamino) thioxomethyl]amino}acetamide
| Molecular Formula | C14H16ClN5OS4 |
|---|---|
| Molecular Weight | 432.99 g/mol |
| LogP | 3.0911 |
| Topological Polar Surface Area | 78.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 432.9926 |
| Heavy Atoms | 25 |
| Complexity | 726.7526 |
Chemical Identifiers
| CAS Number | 489440-91-7 |
|---|---|
| SMILES | CCNC(=S)NNC(=O)CSC1=NN=C(S1)SCC2=CC=CC=C2Cl |
Product Overview
1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea (CAS 489440-91-7), with molecular formula C14H16ClN5OS4 and molecular weight 432.99 g/mol. IUPAC: 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea.
Chemical Property Profile of 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea
Property Insights of 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea
The XLogP value of 3.0911 indicates that 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.94 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea. Following Lipinski's Rule of Five, 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea has 3 hydrogen bond donor(s) and 7 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 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea?
The CAS number of 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea is 489440-91-7.
What is the molecular formula of 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea?
The molecular formula of 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea is C14H16ClN5OS4.
What is the molecular weight of 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea?
The molecular weight of 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea is 432.99 g/mol.
Where can I buy 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea?
You can request a quote for 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-[[5-[(2-chlorophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetyl]amino]-3-ethylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.