![N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide structure](/static/products/328/328068-47-9.png)
N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide
TL;DR: N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide (CAS 328068-47-9) is a chemical compound with molecular formula C22H20N4O4S and molecular weight 436.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-anilino-12,12-dimethyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)furan-2-carboxamide
Also Known As: N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide
| Molecular Formula | C22H20N4O4S |
|---|---|
| Molecular Weight | 436.12 g/mol |
| LogP | 4.0298 |
| Topological Polar Surface Area | 98.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.1205 |
| Heavy Atoms | 31 |
| Complexity | 1323.3069 |
Chemical Identifiers
| CAS Number | 328068-47-9 |
|---|---|
| SMILES | CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)NC4=CC=CC=C4)NC(=O)C5=CC=CO5)C |
Product Overview
N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide (CAS 328068-47-9), with molecular formula C22H20N4O4S and molecular weight 436.12 g/mol. IUPAC: N-(5-anilino-12,12-dimethyl-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl)furan-2-carboxamide.
Chemical Property Profile of N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide
Property Insights of N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide
The XLogP value of 4.0298 indicates that N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.39 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide. Following Lipinski's Rule of Five, N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide has 2 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 N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide?
The CAS number of N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide is 328068-47-9.
What is the molecular formula of N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide?
The molecular formula of N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide is C22H20N4O4S.
What is the molecular weight of N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide?
The molecular weight of N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide is 436.12 g/mol.
Where can I buy N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide?
You can request a quote for N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(6,6-dimethyl-4-oxo-2-(phenylamino)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.