(E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione
TL;DR: (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione (CAS 835888-59-0) is a chemical compound with molecular formula C16H15N3O6 and molecular weight 345.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(E)-2-(3-methoxy-2-prop-2-enoxyphenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione
Also Known As: (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione, 6-{(E)-2-[3-methoxy-2-(prop-2-en-1-yloxy)phenyl]ethenyl}-5-nitropyrimidine-2,4(1H,3H)-dione, 6-[(E)-2-(3-methoxy-2-prop-2-enoxyphenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione, 6-{(E)-2-[3-methoxy-2-(prop-2-en-1-yloxy)phenyl]ethenyl}-5-nitropyrimidine-2,4-diol, 6-{2-[2-(allyloxy)-3-methoxyphenyl]vinyl}-5-nitro-2,4(1H,3H)-pyrimidinedione
| Molecular Formula | C16H15N3O6 |
|---|---|
| Molecular Weight | 345.10 g/mol |
| LogP | 1.7152 |
| Topological Polar Surface Area | 127.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.0961 |
| Heavy Atoms | 25 |
| Complexity | 941.61676 |
Chemical Identifiers
| CAS Number | 835888-59-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1OCC=C)/C=C/C2=C(C(=O)NC(=O)N2)[N+](=O)[O-] |
Product Overview
(E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione (CAS 835888-59-0), with molecular formula C16H15N3O6 and molecular weight 345.10 g/mol. IUPAC: 6-[(E)-2-(3-methoxy-2-prop-2-enoxyphenyl)ethenyl]-5-nitro-1H-pyrimidine-2,4-dione.
Chemical Property Profile of (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione
Property Insights of (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione
The XLogP value of 1.7152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione. The TPSA of 127.32 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione has 2 hydrogen bond donor(s) and 6 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 (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione?
The CAS number of (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione is 835888-59-0.
What is the molecular formula of (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione?
The molecular formula of (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione is C16H15N3O6.
What is the molecular weight of (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione?
The molecular weight of (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione is 345.10 g/mol.
Where can I buy (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione?
You can request a quote for (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-6-(2-(allyloxy)-3-methoxystyryl)-5-nitropyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.