1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea
TL;DR: 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea (CAS 708237-46-1) is a chemical compound with molecular formula C18H27N3O4S and molecular weight 381.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(3,4-diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea
Also Known As: 1-[[2-(3,4-diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea, 2-(3,4-diethoxyphenyl)-N-({[(oxolan-2-ylmethyl)amino]thioxomethyl}amino)acetam ide, 2-[(3,4-diethoxyphenyl)acetyl]-N-(tetrahydrofuran-2-ylmethyl)hydrazinecarbothioamide
| Molecular Formula | C18H27N3O4S |
|---|---|
| Molecular Weight | 381.17 g/mol |
| LogP | 1.7008 |
| Topological Polar Surface Area | 80.85 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 381.17224 |
| Heavy Atoms | 26 |
| Complexity | 606.09906 |
Chemical Identifiers
| CAS Number | 708237-46-1 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CC(=O)NNC(=S)NCC2CCCO2)OCC |
Product Overview
1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea (CAS 708237-46-1), with molecular formula C18H27N3O4S and molecular weight 381.17 g/mol. IUPAC: 1-[[2-(3,4-diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea.
Chemical Property Profile of 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea
Property Insights of 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea
The XLogP value of 1.7008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea. The TPSA of 80.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea. Following Lipinski's Rule of Five, 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea has 3 hydrogen bond donor(s) and 5 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-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea?
The CAS number of 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea is 708237-46-1.
What is the molecular formula of 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea?
The molecular formula of 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea is C18H27N3O4S.
What is the molecular weight of 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea?
The molecular weight of 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea is 381.17 g/mol.
Where can I buy 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea?
You can request a quote for 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-(3,4-Diethoxyphenyl)acetyl]amino]-3-(oxolan-2-ylmethyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.