![3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol structure](/static/products/846/846597-08-8.png)
3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
TL;DR: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol (CAS 846597-08-8) is a chemical compound with molecular formula C28H27N3O5 and molecular weight 485.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-8-ol
Also Known As: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol, 3-(3,4-dimethoxyphenethyl)-4-imino-5-(4-methoxyphenyl)-4,5-dihydro-3H-chromeno[2,3-d]pyrimidin-8-ol, 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-8-ol
| Molecular Formula | C28H27N3O5 |
|---|---|
| Molecular Weight | 485.20 g/mol |
| LogP | 4.62257 |
| Topological Polar Surface Area | 98.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 485.19507 |
| Heavy Atoms | 36 |
| Complexity | 1463.4902 |
Chemical Identifiers
| CAS Number | 846597-08-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2C3=C(C=C(C=C3)O)OC4=C2C(=N)N(C=N4)CCC5=CC(=C(C=C5)OC)OC |
Product Overview
3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol (CAS 846597-08-8), with molecular formula C28H27N3O5 and molecular weight 485.20 g/mol. IUPAC: 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidin-8-ol.
Chemical Property Profile of 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
Property Insights of 3-[2-(3,4-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol
The XLogP value of 4.62257 indicates that 3-[2-(3,4-dimethoxyphenyl)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-dimethoxyphenyl)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-dimethoxyphenyl)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), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[2-(3,4-dimethoxyphenyl)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-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol is 846597-08-8.
What is the molecular formula of 3-[2-(3,4-dimethoxyphenyl)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-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol is C28H27N3O5.
What is the molecular weight of 3-[2-(3,4-dimethoxyphenyl)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-dimethoxyphenyl)ethyl]-4-imino-5-(4-methoxyphenyl)-3,5-dihydro-4H-chromeno[2,3-d]pyrimidin-8-ol is 485.20 g/mol.
Where can I buy 3-[2-(3,4-dimethoxyphenyl)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-dimethoxyphenyl)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-dimethoxyphenyl)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-dimethoxyphenyl)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.