![2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide structure](/static/products/843/843633-70-5.png)
2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide
TL;DR: 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide (CAS 843633-70-5) is a chemical compound with molecular formula C29H30N4O3S and molecular weight 514.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(13,13-dimethyl-7-oxo-6-phenyl-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl)sulfanyl]-N-(1-phenylpropan-2-yl)acetamide
Also Known As: 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide, 2-(7,7-Dimethyl-4-oxo-3-phenyl-3,5,7,8-tetrahydro-4H-6-oxa-1,3,9-triaza-anthracen-2-ylsulfanyl)-N-(1-m ethyl-2-phenyl-ethyl)-acetamide, 2-[(8,8-dimethyl-4-oxo-3-phenyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(1-phenylpropan-2-yl)acetamide
| Molecular Formula | C29H30N4O3S |
|---|---|
| Molecular Weight | 514.20 g/mol |
| LogP | 4.4715 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 514.20386 |
| Heavy Atoms | 37 |
| Complexity | 1486.3064 |
Chemical Identifiers
| CAS Number | 843633-70-5 |
|---|---|
| SMILES | CC(CC1=CC=CC=C1)NC(=O)CSC2=NC3=C(C=C4COC(CC4=N3)(C)C)C(=O)N2C5=CC=CC=C5 |
Product Overview
2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide (CAS 843633-70-5), with molecular formula C29H30N4O3S and molecular weight 514.20 g/mol. IUPAC: 2-[(13,13-dimethyl-7-oxo-6-phenyl-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-5-yl)sulfanyl]-N-(1-phenylpropan-2-yl)acetamide.
Chemical Property Profile of 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide
Property Insights of 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide
The XLogP value of 4.4715 indicates that 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide. Following Lipinski's Rule of Five, 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide has 1 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 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide?
The CAS number of 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide is 843633-70-5.
What is the molecular formula of 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide?
The molecular formula of 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide is C29H30N4O3S.
What is the molecular weight of 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide?
The molecular weight of 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide is 514.20 g/mol.
Where can I buy 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide?
You can request a quote for 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((8,8-dimethyl-4-oxo-3-phenyl-4,6,8,9-tetrahydro-3H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)thio)-N-(1-phenylpropan-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.