![1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea structure](/static/products/726/72668-46-3.png)
1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea
TL;DR: 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea (CAS 72668-46-3) is a chemical compound with molecular formula C12H17N7O3S and molecular weight 339.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]amino]-3-ethylthiourea
Also Known As: 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea, 1-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]amino]-3-ethylthiourea, 2-(2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)acetyl)-N-ethylhydrazinecarbothioamide, 2-(1,3-dimethyl-2,6-dioxo(1,3,7-trihydropurin-7-yl))-N-{[(ethylamino)thioxomet hyl]amino}acetamide, 2-[(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetyl]-N-ethylhydrazinecarbothioamide
| Molecular Formula | C12H17N7O3S |
|---|---|
| Molecular Weight | 339.11 g/mol |
| LogP | -2.0511 |
| Topological Polar Surface Area | 114.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.11136 |
| Heavy Atoms | 23 |
| Complexity | 879.13226 |
Chemical Identifiers
| CAS Number | 72668-46-3 |
|---|---|
| SMILES | CCNC(=S)NNC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C |
Product Overview
1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea (CAS 72668-46-3), with molecular formula C12H17N7O3S and molecular weight 339.11 g/mol. IUPAC: 1-[[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]amino]-3-ethylthiourea.
Chemical Property Profile of 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea
Property Insights of 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea
The XLogP value of -2.0511 indicates that 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea. Following Lipinski's Rule of Five, 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-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-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea?
The CAS number of 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea is 72668-46-3.
What is the molecular formula of 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea?
The molecular formula of 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea is C12H17N7O3S.
What is the molecular weight of 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea?
The molecular weight of 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea is 339.11 g/mol.
Where can I buy 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea?
You can request a quote for 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-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-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]amino]-3-ethyl-thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.