![3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione structure](/static/products/879/879466-68-9.png)
3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
TL;DR: 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione (CAS 879466-68-9) is a chemical compound with molecular formula C25H17N3O6 and molecular weight 455.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-methoxyphenyl)methyl]-2-(4-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-dione
Also Known As: 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-3H-chromeno[2,3-d]pyrimidine-4,5-dione, 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione, 3-[(4-methoxyphenyl)methyl]-2-(4-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-dione
| Molecular Formula | C25H17N3O6 |
|---|---|
| Molecular Weight | 455.11 g/mol |
| LogP | 4.135 |
| Topological Polar Surface Area | 117.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 455.11172 |
| Heavy Atoms | 34 |
| Complexity | 1669.0483 |
Chemical Identifiers
| CAS Number | 879466-68-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4O3)C5=CC=C(C=C5)[N+](=O)[O-] |
Product Overview
3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione (CAS 879466-68-9), with molecular formula C25H17N3O6 and molecular weight 455.11 g/mol. IUPAC: 3-[(4-methoxyphenyl)methyl]-2-(4-nitrophenyl)chromeno[2,3-d]pyrimidine-4,5-dione.
Chemical Property Profile of 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
Property Insights of 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione
The XLogP value of 4.135 indicates that 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione. Following Lipinski's Rule of Five, 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione has 0 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-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione?
The CAS number of 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione is 879466-68-9.
What is the molecular formula of 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione?
The molecular formula of 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione is C25H17N3O6.
What is the molecular weight of 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione?
The molecular weight of 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione is 455.11 g/mol.
Where can I buy 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione?
You can request a quote for 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-methoxybenzyl)-2-(4-nitrophenyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.