BAS 03353578
TL;DR: BAS 03353578 (CAS 474007-46-0) is a chemical compound with molecular formula C20H18F4N2O5 and molecular weight 442.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3,4-dimethoxyphenyl)-5-(4-fluorobenzoyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one
Also Known As: BAS 03353578, AB00118042-01, 6-(3,4-dimethoxyphenyl)-5-(4-fluorobenzoyl)-4-hydroxy-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one, 6-(3,4-dimethoxyphenyl)-5-(4-fluorobenzoyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one, [6-(3,4-dimethoxyphenyl)-2,4-dihydroxy-4-(trifluoromethyl)-1,4,5,6-tetrahydropyrimidin-5-yl](4-fluorophenyl)methanone
| Molecular Formula | C20H18F4N2O5 |
|---|---|
| Molecular Weight | 442.12 g/mol |
| LogP | 2.9468 |
| Topological Polar Surface Area | 96.89 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.11517 |
| Heavy Atoms | 31 |
| Complexity | 996.055 |
Chemical Identifiers
| CAS Number | 474007-46-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2C(C(NC(=O)N2)(C(F)(F)F)O)C(=O)C3=CC=C(C=C3)F)OC |
Product Overview
BAS 03353578 (CAS 474007-46-0), with molecular formula C20H18F4N2O5 and molecular weight 442.12 g/mol. IUPAC: 6-(3,4-dimethoxyphenyl)-5-(4-fluorobenzoyl)-4-hydroxy-4-(trifluoromethyl)-1,3-diazinan-2-one.
Chemical Property Profile of BAS 03353578
Property Insights of BAS 03353578
The XLogP value of 2.9468 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03353578. The TPSA of 96.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03353578. Following Lipinski's Rule of Five, BAS 03353578 has 3 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 03353578?
The CAS number of BAS 03353578 is 474007-46-0.
What is the molecular formula of BAS 03353578?
The molecular formula of BAS 03353578 is C20H18F4N2O5.
What is the molecular weight of BAS 03353578?
The molecular weight of BAS 03353578 is 442.12 g/mol.
Where can I buy BAS 03353578?
You can request a quote for BAS 03353578 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03353578?
Yes, KEHONG BIO provides custom synthesis services for BAS 03353578 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.