![2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide structure](/static/products/499/499116-99-3.png)
2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide
TL;DR: 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide (CAS 499116-99-3) is a chemical compound with molecular formula C22H34N4O2S2 and molecular weight 450.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-amino-12-propan-2-yl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-5-yl)sulfanyl]-N,N-dibutylacetamide
Also Known As: 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide, 2-{[4-amino-6-(propan-2-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N,N-dibutylacetamide
| Molecular Formula | C22H34N4O2S2 |
|---|---|
| Molecular Weight | 450.21 g/mol |
| LogP | 4.8917 |
| Topological Polar Surface Area | 81.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 450.2123 |
| Heavy Atoms | 30 |
| Complexity | 860.4299 |
Chemical Identifiers
| CAS Number | 499116-99-3 |
|---|---|
| SMILES | CCCCN(CCCC)C(=O)CSC1=NC(=C2C3=C(COC(C3)C(C)C)SC2=N1)N |
Product Overview
2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide (CAS 499116-99-3), with molecular formula C22H34N4O2S2 and molecular weight 450.21 g/mol. IUPAC: 2-[(3-amino-12-propan-2-yl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-5-yl)sulfanyl]-N,N-dibutylacetamide.
Chemical Property Profile of 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide
Property Insights of 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide
The XLogP value of 4.8917 indicates that 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide. Following Lipinski's Rule of Five, 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide has 1 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 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide?
The CAS number of 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide is 499116-99-3.
What is the molecular formula of 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide?
The molecular formula of 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide is C22H34N4O2S2.
What is the molecular weight of 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide?
The molecular weight of 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide is 450.21 g/mol.
Where can I buy 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide?
You can request a quote for 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-amino-6-isopropyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N,N-dibutylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.