![N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide structure](/static/products/843/843617-52-7.png)
N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide
TL;DR: N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide (CAS 843617-52-7) is a chemical compound with molecular formula C27H29N5O4S and molecular weight 519.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-methoxyphenyl)-2-[[7-(4-methoxyphenyl)-11,11-dimethyl-12-oxa-3,4,6,8-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7-tetraen-5-yl]sulfanyl]propanamide
Also Known As: N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide, N-(3-methoxyphenyl)-2-{[5-(4-methoxyphenyl)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}propanamide
| Molecular Formula | C27H29N5O4S |
|---|---|
| Molecular Weight | 519.19 g/mol |
| LogP | 4.7791 |
| Topological Polar Surface Area | 99.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 519.19403 |
| Heavy Atoms | 37 |
| Complexity | 1451.4613 |
Chemical Identifiers
| CAS Number | 843617-52-7 |
|---|---|
| SMILES | CC(C(=O)NC1=CC(=CC=C1)OC)SC2=NN=C3N2C(=NC4=C3COC(C4)(C)C)C5=CC=C(C=C5)OC |
Product Overview
N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide (CAS 843617-52-7), with molecular formula C27H29N5O4S and molecular weight 519.19 g/mol. IUPAC: N-(3-methoxyphenyl)-2-[[7-(4-methoxyphenyl)-11,11-dimethyl-12-oxa-3,4,6,8-tetrazatricyclo[7.4.0.02,6]trideca-1(9),2,4,7-tetraen-5-yl]sulfanyl]propanamide.
Chemical Property Profile of N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide
Property Insights of N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide
The XLogP value of 4.7791 indicates that N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.87 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide. Following Lipinski's Rule of Five, N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide?
The CAS number of N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide is 843617-52-7.
What is the molecular formula of N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide?
The molecular formula of N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide is C27H29N5O4S.
What is the molecular weight of N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide?
The molecular weight of N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide is 519.19 g/mol.
Where can I buy N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide?
You can request a quote for N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-methoxyphenyl)-2-((5-(4-methoxyphenyl)-8,8-dimethyl-8,10-dihydro-7H-pyrano[3,4-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.