BAS 00155129
TL;DR: BAS 00155129 (CAS 299945-33-8) is a chemical compound with molecular formula C20H25N3O6 and molecular weight 403.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclooctyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00155129, cyclooctyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, cyclooctyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, cyclooctyl 6-(4-hydroxy-3-nitrophenyl)-4-methyl-2-oxo-1,3,6-trihydropyrimidine -5-carboxylate
| Molecular Formula | C20H25N3O6 |
|---|---|
| Molecular Weight | 403.17 g/mol |
| LogP | 3.5844 |
| Topological Polar Surface Area | 130.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.17435 |
| Heavy Atoms | 29 |
| Complexity | 842.61835 |
Chemical Identifiers
| CAS Number | 299945-33-8 |
|---|---|
| SMILES | CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)O)[N+](=O)[O-])C(=O)OC3CCCCCCC3 |
Product Overview
BAS 00155129 (CAS 299945-33-8), with molecular formula C20H25N3O6 and molecular weight 403.17 g/mol. IUPAC: cyclooctyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00155129
Property Insights of BAS 00155129
The XLogP value of 3.5844 indicates that BAS 00155129 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.8 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00155129. Following Lipinski's Rule of Five, BAS 00155129 has 3 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 00155129?
The CAS number of BAS 00155129 is 299945-33-8.
What is the molecular formula of BAS 00155129?
The molecular formula of BAS 00155129 is C20H25N3O6.
What is the molecular weight of BAS 00155129?
The molecular weight of BAS 00155129 is 403.17 g/mol.
Where can I buy BAS 00155129?
You can request a quote for BAS 00155129 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00155129?
Yes, KEHONG BIO provides custom synthesis services for BAS 00155129 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.