![N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine structure](/static/products/844/844656-17-3.png)
N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine
TL;DR: N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine (CAS 844656-17-3) is a chemical compound with molecular formula C19H30N4OS2 and molecular weight 394.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(12-ethyl-12-methyl-5-propan-2-ylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)-N',N'-dimethylethane-1,2-diamine
Also Known As: N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine, N1-(6-ethyl-2-(isopropylthio)-6-methyl-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)-N2,N2-dimethylethane-1,2-diamine
| Molecular Formula | C19H30N4OS2 |
|---|---|
| Molecular Weight | 394.19 g/mol |
| LogP | 4.4067 |
| Topological Polar Surface Area | 50.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 394.1861 |
| Heavy Atoms | 26 |
| Complexity | 774.47516 |
Chemical Identifiers
| CAS Number | 844656-17-3 |
|---|---|
| SMILES | CCC1(CC2=C(CO1)SC3=NC(=NC(=C23)NCCN(C)C)SC(C)C)C |
Product Overview
N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine (CAS 844656-17-3), with molecular formula C19H30N4OS2 and molecular weight 394.19 g/mol. IUPAC: N-(12-ethyl-12-methyl-5-propan-2-ylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)-N',N'-dimethylethane-1,2-diamine.
Chemical Property Profile of N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine
Property Insights of N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine
The XLogP value of 4.4067 indicates that N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.28 Ų, N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine 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 N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine?
The CAS number of N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine is 844656-17-3.
What is the molecular formula of N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine?
The molecular formula of N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine is C19H30N4OS2.
What is the molecular weight of N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine?
The molecular weight of N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine is 394.19 g/mol.
Where can I buy N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine?
You can request a quote for N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for N'-[6-ethyl-6-methyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]-N,N-dimethylethane-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.