BAS 00944051
TL;DR: BAS 00944051 (CAS 333768-40-4) is a chemical compound with molecular formula C20H20ClN3O4 and molecular weight 401.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
Also Known As: BAS 00944051, BIM-0049237.P001, N-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide, AB00095921-01, AJ-292/12641070
| Molecular Formula | C20H20ClN3O4 |
|---|---|
| Molecular Weight | 401.11 g/mol |
| LogP | 3.7109 |
| Topological Polar Surface Area | 99.69 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.11423 |
| Heavy Atoms | 28 |
| Complexity | 940.96704 |
Chemical Identifiers
| CAS Number | 333768-40-4 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C(=C(NC(=O)N2)C)C(=O)NC3=CC=C(C=C3)Cl)O |
Product Overview
BAS 00944051 (CAS 333768-40-4), with molecular formula C20H20ClN3O4 and molecular weight 401.11 g/mol. IUPAC: N-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide.
Chemical Property Profile of BAS 00944051
Property Insights of BAS 00944051
The XLogP value of 3.7109 indicates that BAS 00944051 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.69 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00944051. Following Lipinski's Rule of Five, BAS 00944051 has 4 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 00944051?
The CAS number of BAS 00944051 is 333768-40-4.
What is the molecular formula of BAS 00944051?
The molecular formula of BAS 00944051 is C20H20ClN3O4.
What is the molecular weight of BAS 00944051?
The molecular weight of BAS 00944051 is 401.11 g/mol.
Where can I buy BAS 00944051?
You can request a quote for BAS 00944051 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00944051?
Yes, KEHONG BIO provides custom synthesis services for BAS 00944051 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.