![1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione structure](/static/products/844/844456-82-2.png)
1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione
TL;DR: 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione (CAS 844456-82-2) is a chemical compound with molecular formula C22H31N3OS and molecular weight 385.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(diethylamino)propyl]-7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione
Also Known As: 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione, 1-[3-(diethylamino)propyl]-7,7-dimethyl-2-phenyl-1,5,7,8-tetrahydro-4H-pyrano[4,3-d]pyrimidine-4-thione, 1-[3-(diethylamino)propyl]-7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione
| Molecular Formula | C22H31N3OS |
|---|---|
| Molecular Weight | 385.22 g/mol |
| LogP | 4.86279 |
| Topological Polar Surface Area | 30.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 385.21878 |
| Heavy Atoms | 27 |
| Complexity | 825.4418 |
Chemical Identifiers
| CAS Number | 844456-82-2 |
|---|---|
| SMILES | CCN(CC)CCCN1C2=C(COC(C2)(C)C)C(=S)N=C1C3=CC=CC=C3 |
Product Overview
1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione (CAS 844456-82-2), with molecular formula C22H31N3OS and molecular weight 385.22 g/mol. IUPAC: 1-[3-(diethylamino)propyl]-7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidine-4-thione.
Chemical Property Profile of 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione
Property Insights of 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione
The XLogP value of 4.86279 indicates that 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.29 Ų, 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione has 0 hydrogen bond donor(s) and 4 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 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione?
The CAS number of 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione is 844456-82-2.
What is the molecular formula of 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione?
The molecular formula of 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione is C22H31N3OS.
What is the molecular weight of 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione?
The molecular weight of 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione is 385.22 g/mol.
Where can I buy 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione?
You can request a quote for 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-(diethylamino)propyl)-7,7-dimethyl-2-phenyl-7,8-dihydro-1H-pyrano[4,3-d]pyrimidine-4(5H)-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.