BAS 00279091
TL;DR: BAS 00279091 (CAS 285986-87-0) is a chemical compound with molecular formula C18H17N3O6 and molecular weight 371.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-methyl-4-[5-(3-nitrophenyl)furan-2-yl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00279091, AB00125007-02, ethyl 6-methyl-4-[5-(3-nitrophenyl)furan-2-yl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, F0095-0125, ethyl 6-methyl-4-[5-(3-nitrophenyl)-2-furyl]-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C18H17N3O6 |
|---|---|
| Molecular Weight | 371.11 g/mol |
| LogP | 3.0458 |
| Topological Polar Surface Area | 123.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.11172 |
| Heavy Atoms | 27 |
| Complexity | 946.07855 |
Chemical Identifiers
| CAS Number | 285986-87-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])C |
Product Overview
BAS 00279091 (CAS 285986-87-0), with molecular formula C18H17N3O6 and molecular weight 371.11 g/mol. IUPAC: ethyl 6-methyl-4-[5-(3-nitrophenyl)furan-2-yl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00279091
Property Insights of BAS 00279091
The XLogP value of 3.0458 indicates that BAS 00279091 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 123.71 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00279091. Following Lipinski's Rule of Five, BAS 00279091 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 BAS 00279091?
The CAS number of BAS 00279091 is 285986-87-0.
What is the molecular formula of BAS 00279091?
The molecular formula of BAS 00279091 is C18H17N3O6.
What is the molecular weight of BAS 00279091?
The molecular weight of BAS 00279091 is 371.11 g/mol.
Where can I buy BAS 00279091?
You can request a quote for BAS 00279091 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00279091?
Yes, KEHONG BIO provides custom synthesis services for BAS 00279091 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.