![6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one structure](/static/products/3853/385392-29-0.webp)
6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
TL;DR: 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one (CAS 385392-29-0) is a chemical compound with molecular formula C26H31N3O3S2 and molecular weight 497.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-4-(3-methylphenyl)-5-(1-oxo-1-piperidin-1-ylpropan-2-yl)sulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Also Known As: 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one, 6,6-dimethyl-2-((1-oxo-1-(piperidin-1-yl)propan-2-yl)thio)-3-(m-tolyl)-5,6-dihydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4(8H)-one, 6,6-DIMETHYL-2-[(1-METHYL-2-OXO-2-PIPERIDINOETHYL)SULFANYL]-3-(3-METHYLPHENYL)-3,5,6,8-TETRAHYDRO-4H-PYRANO[4',3':4,5]THIENO[2,3-D]PYRIMIDIN-4-ONE, 6,6-dimethyl-3-(3-methylphenyl)-2-(1-oxo-1-piperidin-1-ylpropan-2-yl)sulfanyl-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-one
| Molecular Formula | C26H31N3O3S2 |
|---|---|
| Molecular Weight | 497.18 g/mol |
| LogP | 5.10002 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 497.1807 |
| Heavy Atoms | 34 |
| Complexity | 1304.5985 |
Chemical Identifiers
| CAS Number | 385392-29-0 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SC(C)C(=O)N4CCCCC4)SC5=C3CC(OC5)(C)C |
Product Overview
6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one (CAS 385392-29-0), with molecular formula C26H31N3O3S2 and molecular weight 497.18 g/mol. IUPAC: 12,12-dimethyl-4-(3-methylphenyl)-5-(1-oxo-1-piperidin-1-ylpropan-2-yl)sulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one.
Chemical Property Profile of 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Property Insights of 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
The XLogP value of 5.10002 indicates that 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one. Following Lipinski's Rule of Five, 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one?
The CAS number of 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one is 385392-29-0.
What is the molecular formula of 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one?
The molecular formula of 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one is C26H31N3O3S2.
What is the molecular weight of 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one?
The molecular weight of 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one is 497.18 g/mol.
Where can I buy 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one?
You can request a quote for 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6,6-dimethyl-3-(3-methylphenyl)-2-{[1-oxo-1-(piperidin-1-yl)propan-2-yl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.