![6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione structure](/static/products/5606/5606-57-5.webp)
6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione
TL;DR: 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione (CAS 5606-57-5) is a chemical compound with molecular formula C20H23N5O4S2 and molecular weight 461.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione
Also Known As: 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione, 6-Amino-5-{[(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl}-1,3-dimethylpyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C20H23N5O4S2 |
|---|---|
| Molecular Weight | 461.12 g/mol |
| LogP | 1.3113 |
| Topological Polar Surface Area | 121.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 461.11914 |
| Heavy Atoms | 31 |
| Complexity | 1396.0221 |
Chemical Identifiers
| CAS Number | 5606-57-5 |
|---|---|
| SMILES | CCN1C(=O)C2=C(N=C1SCC(=O)C3=C(N(C(=O)N(C3=O)C)C)N)SC4=C2CCCC4 |
Product Overview
6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione (CAS 5606-57-5), with molecular formula C20H23N5O4S2 and molecular weight 461.12 g/mol. IUPAC: 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione.
Chemical Property Profile of 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione
Property Insights of 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione
The XLogP value of 1.3113 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione. The TPSA of 121.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione. Following Lipinski's Rule of Five, 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione has 1 hydrogen bond donor(s) and 8 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 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione?
The CAS number of 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione is 5606-57-5.
What is the molecular formula of 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione?
The molecular formula of 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione is C20H23N5O4S2.
What is the molecular weight of 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione?
The molecular weight of 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione is 461.12 g/mol.
Where can I buy 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione?
You can request a quote for 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 6-amino-5-[2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetyl]-1,3-dimethylpyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.