![2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide structure](/static/products/586/586993-41-1.png)
2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide
TL;DR: 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide (CAS 586993-41-1) is a chemical compound with molecular formula C24H24N4O4S and molecular weight 464.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5,5-dimethyl-15-oxo-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11(16),12-pentaen-14-yl)-N-(4-methoxyphenyl)propanamide
Also Known As: 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide, 2-(8,8-dimethyl-4-oxo-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3(4H)-yl)-N-(4-methoxyphenyl)propanamide
| Molecular Formula | C24H24N4O4S |
|---|---|
| Molecular Weight | 464.15 g/mol |
| LogP | 4.0658 |
| Topological Polar Surface Area | 95.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 464.15182 |
| Heavy Atoms | 33 |
| Complexity | 1439.1465 |
Chemical Identifiers
| CAS Number | 586993-41-1 |
|---|---|
| SMILES | CC(C(=O)NC1=CC=C(C=C1)OC)N2C=NC3=C(C2=O)SC4=C3C=C5COC(CC5=N4)(C)C |
Product Overview
2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide (CAS 586993-41-1), with molecular formula C24H24N4O4S and molecular weight 464.15 g/mol. IUPAC: 2-(5,5-dimethyl-15-oxo-6-oxa-17-thia-2,12,14-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3(8),9,11(16),12-pentaen-14-yl)-N-(4-methoxyphenyl)propanamide.
Chemical Property Profile of 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide
Property Insights of 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide
The XLogP value of 4.0658 indicates that 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide. Following Lipinski's Rule of Five, 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide has 1 hydrogen bond donor(s) and 7 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-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide?
The CAS number of 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide is 586993-41-1.
What is the molecular formula of 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide?
The molecular formula of 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide is C24H24N4O4S.
What is the molecular weight of 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide?
The molecular weight of 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide is 464.15 g/mol.
Where can I buy 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide?
You can request a quote for 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide 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-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(8,8-dimethyl-4-oxo-4,7,8,10-tetrahydro-3H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-3-yl)-N-(4-methoxyphenyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.