![3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol structure](/static/products/848/848684-21-9.png)
3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
TL;DR: 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol (CAS 848684-21-9) is a chemical compound with molecular formula C30H31N3O5 and molecular weight 513.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-8-ol
Also Known As: 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol, 3-(3,4-diethoxyphenethyl)-4-imino-5-(4-methoxyphenyl)-4,5-dihydro-3H-chromeno[2,3-d]pyrimidin-8-ol, 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-8-ol
| Molecular Formula | C30H31N3O5 |
|---|---|
| Molecular Weight | 513.23 g/mol |
| LogP | 5.40277 |
| Topological Polar Surface Area | 98.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 513.2264 |
| Heavy Atoms | 38 |
| Complexity | 1497.2448 |
Chemical Identifiers
| CAS Number | 848684-21-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)CCN2C=NC3=C(C2=N)C(C4=C(O3)C=C(C=C4)O)C5=CC=C(C=C5)OC)OCC |
Product Overview
3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol (CAS 848684-21-9), with molecular formula C30H31N3O5 and molecular weight 513.23 g/mol. IUPAC: 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-8-ol.
Chemical Property Profile of 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Property Insights of 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
The XLogP value of 5.40277 indicates that 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol. Following Lipinski's Rule of Five, 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol?
The CAS number of 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol is 848684-21-9.
What is the molecular formula of 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol?
The molecular formula of 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol is C30H31N3O5.
What is the molecular weight of 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol?
The molecular weight of 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol is 513.23 g/mol.
Where can I buy 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol?
You can request a quote for 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(3,4-diethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.