![2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone structure](/static/products/900/900890-72-4.png)
2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone
TL;DR: 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone (CAS 900890-72-4) 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-(3-methylphenyl)-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl]sulfanyl]-1-morpholin-4-ylethanone
Also Known As: 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone, 2-[[7,7-dimethyl-2-(3-methylphenyl)-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl]sulfanyl]-1-morpholin-4-ylethanone, 2-{[7,7-dimethyl-2-(3-methylphenyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl]sulfanyl}-1-(morpholin-4-yl)ethanone
| Molecular Formula | C22H27N3O3S |
|---|---|
| Molecular Weight | 413.18 g/mol |
| LogP | 3.25422 |
| 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 | 910.17065 |
Chemical Identifiers
| CAS Number | 900890-72-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C2=NC3=C(COC(C3)(C)C)C(=N2)SCC(=O)N4CCOCC4 |
Product Overview
2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone (CAS 900890-72-4), with molecular formula C22H27N3O3S and molecular weight 413.18 g/mol. IUPAC: 2-[[7,7-dimethyl-2-(3-methylphenyl)-5,8-dihydropyrano[4,3-d]pyrimidin-4-yl]sulfanyl]-1-morpholin-4-ylethanone.
Chemical Property Profile of 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone
Property Insights of 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone
The XLogP value of 3.25422 indicates that 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone 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-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone. Following Lipinski's Rule of Five, 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone 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-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone?
The CAS number of 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone is 900890-72-4.
What is the molecular formula of 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone?
The molecular formula of 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone is C22H27N3O3S.
What is the molecular weight of 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone?
The molecular weight of 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone is 413.18 g/mol.
Where can I buy 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone?
You can request a quote for 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone 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-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-((7,7-dimethyl-2-(m-tolyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-yl)thio)-1-morpholinoethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.