BAS 03353561
TL;DR: BAS 03353561 (CAS 474007-91-5) is a chemical compound with molecular formula C20H19F3N2O5 and molecular weight 424.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzoyl-6-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one
Also Known As: BAS 03353561, AB00118265-01, AF-399/15599055, 5-benzoyl-6-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one, 5-benzoyl-6-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-4-(trifluoromethyl)tetrahydro-2(1H)-pyrimidinone
| Molecular Formula | C20H19F3N2O5 |
|---|---|
| Molecular Weight | 424.12 g/mol |
| LogP | 2.8948 |
| Topological Polar Surface Area | 107.89 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.1246 |
| Heavy Atoms | 30 |
| Complexity | 951.2033 |
Chemical Identifiers
| CAS Number | 474007-91-5 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C(C(NC(=O)N2)(C(F)(F)F)O)C(=O)C3=CC=CC=C3)O |
Product Overview
BAS 03353561 (CAS 474007-91-5), with molecular formula C20H19F3N2O5 and molecular weight 424.12 g/mol. IUPAC: 5-benzoyl-6-(3-ethoxy-4-hydroxyphenyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one.
Chemical Property Profile of BAS 03353561
Property Insights of BAS 03353561
The XLogP value of 2.8948 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03353561. The TPSA of 107.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03353561. Following Lipinski's Rule of Five, BAS 03353561 has 4 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 03353561?
The CAS number of BAS 03353561 is 474007-91-5.
What is the molecular formula of BAS 03353561?
The molecular formula of BAS 03353561 is C20H19F3N2O5.
What is the molecular weight of BAS 03353561?
The molecular weight of BAS 03353561 is 424.12 g/mol.
Where can I buy BAS 03353561?
You can request a quote for BAS 03353561 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03353561?
Yes, KEHONG BIO provides custom synthesis services for BAS 03353561 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.