N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide
TL;DR: N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide (CAS 306967-32-8) is a chemical compound with molecular formula C29H31N3O3S and molecular weight 501.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-butyl-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)-2,2-diphenylacetamide
Also Known As: N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide, N-(2-butyl-6,6-dimethyl-4-oxo-5,8-dihydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3(6H)-yl)-2,2-diphenylacetamide
| Molecular Formula | C29H31N3O3S |
|---|---|
| Molecular Weight | 501.21 g/mol |
| LogP | 5.5541 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 501.20862 |
| Heavy Atoms | 36 |
| Complexity | 1402.1534 |
Chemical Identifiers
| CAS Number | 306967-32-8 |
|---|---|
| SMILES | CCCCC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1NC(=O)C(C4=CC=CC=C4)C5=CC=CC=C5 |
Product Overview
N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide (CAS 306967-32-8), with molecular formula C29H31N3O3S and molecular weight 501.21 g/mol. IUPAC: N-(5-butyl-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)-2,2-diphenylacetamide.
Chemical Property Profile of N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide
Property Insights of N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide
The XLogP value of 5.5541 indicates that N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide. Following Lipinski's Rule of Five, N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide?
The CAS number of N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide is 306967-32-8.
What is the molecular formula of N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide?
The molecular formula of N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide is C29H31N3O3S.
What is the molecular weight of N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide?
The molecular weight of N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide is 501.21 g/mol.
Where can I buy N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide?
You can request a quote for N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-butyl-6,6-dimethyl-4-oxo-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-3-yl)-2,2-diphenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.