![4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid structure](/static/products/370/370841-89-7.png)
4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid
TL;DR: 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid (CAS 370841-89-7) is a chemical compound with molecular formula C17H21N3O4S and molecular weight 363.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-[(4-oxo-2-propyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)amino]butanoic acid
Also Known As: 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid, 4-oxo-4-[(4-oxo-2-propyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)amino]butanoic acid, N-(4-Oxo-2-propyl-5,6,7,8-tetrahydro-4H-benzo[4,5]thieno[2,3-d]pyrimidin-3-yl)-succinamic acid, 4-keto-4-[(4-keto-2-propyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-3-yl)amino]butyric acid, 4-oxidanylidene-4-[(4-oxidanylidene-2-propyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)amino]butanoic acid
| Molecular Formula | C17H21N3O4S |
|---|---|
| Molecular Weight | 363.13 g/mol |
| LogP | 2.2242 |
| Topological Polar Surface Area | 101.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 363.12527 |
| Heavy Atoms | 25 |
| Complexity | 884.1258 |
Chemical Identifiers
| CAS Number | 370841-89-7 |
|---|---|
| SMILES | CCCC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1NC(=O)CCC(=O)O |
Product Overview
4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid (CAS 370841-89-7), with molecular formula C17H21N3O4S and molecular weight 363.13 g/mol. IUPAC: 4-oxo-4-[(4-oxo-2-propyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)amino]butanoic acid.
Chemical Property Profile of 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid
Property Insights of 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid
The XLogP value of 2.2242 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid. The TPSA of 101.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid. Following Lipinski's Rule of Five, 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid has 2 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 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid?
The CAS number of 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid is 370841-89-7.
What is the molecular formula of 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid?
The molecular formula of 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid is C17H21N3O4S.
What is the molecular weight of 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid?
The molecular weight of 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid is 363.13 g/mol.
Where can I buy 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid?
You can request a quote for 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-oxo-4-((4-oxo-2-propyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-3(4H)-yl)amino)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.