BAS 03539531
TL;DR: BAS 03539531 (CAS 418798-15-9) is a chemical compound with molecular formula C16H20N2O5 and molecular weight 320.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-ethoxy-3-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 03539531, methyl 4-(4-ethoxy-3-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, AB00090214-01, methyl 4-(4-ethoxy-3-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, METHYL 4-(4-ETHOXY-3-METHOXY-PHENYL)-6-METHYL-2-OXO-3,4-DIHYDRO-1H-PYRIMIDINE-5-CARBOXYLATE
| Molecular Formula | C16H20N2O5 |
|---|---|
| Molecular Weight | 320.14 g/mol |
| LogP | 1.8948 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 320.1372 |
| Heavy Atoms | 23 |
| Complexity | 653.8707 |
Chemical Identifiers
| CAS Number | 418798-15-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2C(=C(NC(=O)N2)C)C(=O)OC)OC |
Product Overview
BAS 03539531 (CAS 418798-15-9), with molecular formula C16H20N2O5 and molecular weight 320.14 g/mol. IUPAC: methyl 4-(4-ethoxy-3-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 03539531
Property Insights of BAS 03539531
The XLogP value of 1.8948 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03539531. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03539531. Following Lipinski's Rule of Five, BAS 03539531 has 2 hydrogen bond donor(s) and 5 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 BAS 03539531?
The CAS number of BAS 03539531 is 418798-15-9.
What is the molecular formula of BAS 03539531?
The molecular formula of BAS 03539531 is C16H20N2O5.
What is the molecular weight of BAS 03539531?
The molecular weight of BAS 03539531 is 320.14 g/mol.
Where can I buy BAS 03539531?
You can request a quote for BAS 03539531 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03539531?
Yes, KEHONG BIO provides custom synthesis services for BAS 03539531 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.