BAS 00485437
TL;DR: BAS 00485437 (CAS 299945-28-1) is a chemical compound with molecular formula C21H26N2O5 and molecular weight 386.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclooctyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00485437, cyclooctyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, cyclooctyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, cyclooctyl 4-(2H-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, cyclooctyl 4-(benzo[d][1,3]dioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C21H26N2O5 |
|---|---|
| Molecular Weight | 386.18 g/mol |
| LogP | 3.6993 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 386.18417 |
| Heavy Atoms | 28 |
| Complexity | 795.9857 |
Chemical Identifiers
| CAS Number | 299945-28-1 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC3=C(C=C2)OCO3)C(=O)OC4CCCCCCC4 |
Product Overview
BAS 00485437 (CAS 299945-28-1), with molecular formula C21H26N2O5 and molecular weight 386.18 g/mol. IUPAC: cyclooctyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00485437
Property Insights of BAS 00485437
The XLogP value of 3.6993 indicates that BAS 00485437 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00485437. Following Lipinski's Rule of Five, BAS 00485437 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 00485437?
The CAS number of BAS 00485437 is 299945-28-1.
What is the molecular formula of BAS 00485437?
The molecular formula of BAS 00485437 is C21H26N2O5.
What is the molecular weight of BAS 00485437?
The molecular weight of BAS 00485437 is 386.18 g/mol.
Where can I buy BAS 00485437?
You can request a quote for BAS 00485437 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00485437?
Yes, KEHONG BIO provides custom synthesis services for BAS 00485437 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.