BAS 03538319
TL;DR: BAS 03538319 (CAS 474303-03-2) is a chemical compound with molecular formula C21H18F4N2O4 and molecular weight 438.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-fluorobenzoyl)-4-hydroxy-6-(4-prop-2-enoxyphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one
Also Known As: BAS 03538319, 6-[4-(allyloxy)phenyl]-5-(4-fluorobenzoyl)-4-hydroxy-4-(trifluoromethyl)tetrahydro-2(1H)-pyrimidinone, 5-(4-fluorobenzoyl)-4-hydroxy-6-(4-prop-2-enoxyphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one, 5-(4-fluorobenzoyl)-4-hydroxy-6-[4-(prop-2-en-1-yloxy)phenyl]-4-(trifluoromethyl)-1,3-diazinan-2-one, 5-[(4-fluorophenyl)carbonyl]-4-hydroxy-6-(4-prop-2-enyloxyphenyl)-4-(trifluoro methyl)-1,3-diazaperhydroin-2-one
| Molecular Formula | C21H18F4N2O4 |
|---|---|
| Molecular Weight | 438.12 g/mol |
| LogP | 3.4944 |
| Topological Polar Surface Area | 87.66 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.12027 |
| Heavy Atoms | 31 |
| Complexity | 976.3694 |
Chemical Identifiers
| CAS Number | 474303-03-2 |
|---|---|
| SMILES | C=CCOC1=CC=C(C=C1)C2C(C(NC(=O)N2)(C(F)(F)F)O)C(=O)C3=CC=C(C=C3)F |
Product Overview
BAS 03538319 (CAS 474303-03-2), with molecular formula C21H18F4N2O4 and molecular weight 438.12 g/mol. IUPAC: 5-(4-fluorobenzoyl)-4-hydroxy-6-(4-prop-2-enoxyphenyl)-4-(trifluoromethyl)-1,3-diazinan-2-one.
Chemical Property Profile of BAS 03538319
Property Insights of BAS 03538319
The XLogP value of 3.4944 indicates that BAS 03538319 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.66 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03538319. Following Lipinski's Rule of Five, BAS 03538319 has 3 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 03538319?
The CAS number of BAS 03538319 is 474303-03-2.
What is the molecular formula of BAS 03538319?
The molecular formula of BAS 03538319 is C21H18F4N2O4.
What is the molecular weight of BAS 03538319?
The molecular weight of BAS 03538319 is 438.12 g/mol.
Where can I buy BAS 03538319?
You can request a quote for BAS 03538319 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03538319?
Yes, KEHONG BIO provides custom synthesis services for BAS 03538319 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.