![4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide structure](/static/products/865/865656-77-5.png)
4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide
TL;DR: 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide (CAS 865656-77-5) is a chemical compound with molecular formula C24H31N5O4S and molecular weight 485.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]butanamide
Also Known As: 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide, 4-(2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide, 4-(2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]butanamide, 4-(2,4-dioxo-1,2-dihydrothieno[3,2-d]pyrimidin-3(4H)-yl)-N-(3-(4-(4-methoxyphenyl)piperazin-1-yl)propyl)butanamide
| Molecular Formula | C24H31N5O4S |
|---|---|
| Molecular Weight | 485.21 g/mol |
| LogP | 1.8686 |
| Topological Polar Surface Area | 99.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 485.2097 |
| Heavy Atoms | 34 |
| Complexity | 1208.5667 |
Chemical Identifiers
| CAS Number | 865656-77-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)CCCN3C(=O)C4=C(C=CS4)NC3=O |
Product Overview
4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide (CAS 865656-77-5), with molecular formula C24H31N5O4S and molecular weight 485.21 g/mol. IUPAC: 4-(2,4-dioxo-1H-thieno[3,2-d]pyrimidin-3-yl)-N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]butanamide.
Chemical Property Profile of 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide
Property Insights of 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide
The XLogP value of 1.8686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide. The TPSA of 99.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide. Following Lipinski's Rule of Five, 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide has 2 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 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide?
The CAS number of 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide is 865656-77-5.
What is the molecular formula of 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide?
The molecular formula of 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide is C24H31N5O4S.
What is the molecular weight of 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide?
The molecular weight of 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide is 485.21 g/mol.
Where can I buy 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide?
You can request a quote for 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-{2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-3-yl}-N-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.