![2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one structure](/static/products/577/577987-03-2.png)
2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one
TL;DR: 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one (CAS 577987-03-2) is a chemical compound with molecular formula C22H27N3O3S and molecular weight 413.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-1-morpholin-4-ylpropan-1-one
Also Known As: 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one, 2-(7,7-Dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-ylsulfanyl)-1-morpholin-4-yl-propan-1 -one, 2-[(7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-1-morpholin-4-ylpropan-1-one, 2-[(7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-1-(morpholin-4-yl)propan-1-one
| Molecular Formula | C22H27N3O3S |
|---|---|
| Molecular Weight | 413.18 g/mol |
| LogP | 3.3343 |
| Topological Polar Surface Area | 64.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.1773 |
| Heavy Atoms | 29 |
| Complexity | 882.3713 |
Chemical Identifiers
| CAS Number | 577987-03-2 |
|---|---|
| SMILES | CC(C(=O)N1CCOCC1)SC2=NC(=NC3=C2COC(C3)(C)C)C4=CC=CC=C4 |
Product Overview
2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one (CAS 577987-03-2), with molecular formula C22H27N3O3S and molecular weight 413.18 g/mol. IUPAC: 2-[(7,7-dimethyl-2-phenyl-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl)sulfanyl]-1-morpholin-4-ylpropan-1-one.
Chemical Property Profile of 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one
Property Insights of 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one
The XLogP value of 3.3343 indicates that 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one. Following Lipinski's Rule of Five, 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one has 0 hydrogen bond donor(s) and 6 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-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one?
The CAS number of 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one is 577987-03-2.
What is the molecular formula of 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one?
The molecular formula of 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one is C22H27N3O3S.
What is the molecular weight of 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one?
The molecular weight of 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one is 413.18 g/mol.
Where can I buy 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one?
You can request a quote for 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-((7,7-dimethyl-2-phenyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinopropan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.