BAS 00554157
TL;DR: BAS 00554157 (CAS 328243-60-3) is a chemical compound with molecular formula C19H19N3O7 and molecular weight 401.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00554157, ethyl 4-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 4-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, ethyl 4-(5-(4-methoxy-2-nitrophenyl)furan-2-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 4-(5-{2-nitro-4-methoxyphenyl}-2-furyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
| Molecular Formula | C19H19N3O7 |
|---|---|
| Molecular Weight | 401.12 g/mol |
| LogP | 3.0544 |
| Topological Polar Surface Area | 132.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 401.1223 |
| Heavy Atoms | 29 |
| Complexity | 1008.98175 |
Chemical Identifiers
| CAS Number | 328243-60-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(O2)C3=C(C=C(C=C3)OC)[N+](=O)[O-])C |
Product Overview
BAS 00554157 (CAS 328243-60-3), with molecular formula C19H19N3O7 and molecular weight 401.12 g/mol. IUPAC: ethyl 4-[5-(4-methoxy-2-nitrophenyl)furan-2-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00554157
Property Insights of BAS 00554157
The XLogP value of 3.0544 indicates that BAS 00554157 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.94 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00554157. Following Lipinski's Rule of Five, BAS 00554157 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 BAS 00554157?
The CAS number of BAS 00554157 is 328243-60-3.
What is the molecular formula of BAS 00554157?
The molecular formula of BAS 00554157 is C19H19N3O7.
What is the molecular weight of BAS 00554157?
The molecular weight of BAS 00554157 is 401.12 g/mol.
Where can I buy BAS 00554157?
You can request a quote for BAS 00554157 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00554157?
Yes, KEHONG BIO provides custom synthesis services for BAS 00554157 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.