A1806/0076300
TL;DR: A1806/0076300 (CAS 330674-30-1) is a chemical compound with molecular formula C18H22N2O4 and molecular weight 330.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-but-2-enyl] 4-(3-ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: A1806/0076300, [(E)-but-2-enyl] 4-(3-ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, 2-butenyl 4-(3-ethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate, (2E)-but-2-en-1-yl 4-(3-ethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, (2E)but-2-enyl 6-(3-ethoxyphenyl)-4-methyl-2-oxo-1,3,6-trihydropyrimidine-5-ca rboxylate
| Molecular Formula | C18H22N2O4 |
|---|---|
| Molecular Weight | 330.16 g/mol |
| LogP | 2.8325 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 330.15796 |
| Heavy Atoms | 24 |
| Complexity | 679.35126 |
Chemical Identifiers
| CAS Number | 330674-30-1 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)OC/C=C/C |
Product Overview
A1806/0076300 (CAS 330674-30-1), with molecular formula C18H22N2O4 and molecular weight 330.16 g/mol. IUPAC: [(E)-but-2-enyl] 4-(3-ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of A1806/0076300
Property Insights of A1806/0076300
The XLogP value of 2.8325 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A1806/0076300. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for A1806/0076300. Following Lipinski's Rule of Five, A1806/0076300 has 2 hydrogen bond donor(s) and 4 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 A1806/0076300?
The CAS number of A1806/0076300 is 330674-30-1.
What is the molecular formula of A1806/0076300?
The molecular formula of A1806/0076300 is C18H22N2O4.
What is the molecular weight of A1806/0076300?
The molecular weight of A1806/0076300 is 330.16 g/mol.
Where can I buy A1806/0076300?
You can request a quote for A1806/0076300 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1806/0076300?
Yes, KEHONG BIO provides custom synthesis services for A1806/0076300 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.