BAS 00553062
TL;DR: BAS 00553062 (CAS 301319-89-1) is a chemical compound with molecular formula C18H24N2O4 and molecular weight 332.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 6-(2-butoxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate
Also Known As: BAS 00553062, methyl 4-(2-butoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, Methyl 4-(2-butoxyphenyl)-1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-5-pyrimidinecarboxylate, METHYL 4-(2-BUTOXYPHENYL)-1,6-DIMETHYL-2-OXO-3,4-DIHYDROPYRIMIDINE-5-CARBOXYLATE, methyl 6-(2-butoxyphenyl)-3,4-dimethyl-2-oxo-1,3,6-trihydropyrimidine-5-carbox ylate
| Molecular Formula | C18H24N2O4 |
|---|---|
| Molecular Weight | 332.17 g/mol |
| LogP | 3.0086 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 332.1736 |
| Heavy Atoms | 24 |
| Complexity | 654.17377 |
Chemical Identifiers
| CAS Number | 301319-89-1 |
|---|---|
| SMILES | CCCCOC1=CC=CC=C1C2C(=C(N(C(=O)N2)C)C)C(=O)OC |
Product Overview
BAS 00553062 (CAS 301319-89-1), with molecular formula C18H24N2O4 and molecular weight 332.17 g/mol. IUPAC: methyl 6-(2-butoxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00553062
Property Insights of BAS 00553062
The XLogP value of 3.0086 indicates that BAS 00553062 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00553062. Following Lipinski's Rule of Five, BAS 00553062 has 1 hydrogen bond donor(s) and 4 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 00553062?
The CAS number of BAS 00553062 is 301319-89-1.
What is the molecular formula of BAS 00553062?
The molecular formula of BAS 00553062 is C18H24N2O4.
What is the molecular weight of BAS 00553062?
The molecular weight of BAS 00553062 is 332.17 g/mol.
Where can I buy BAS 00553062?
You can request a quote for BAS 00553062 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00553062?
Yes, KEHONG BIO provides custom synthesis services for BAS 00553062 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.