BAS 03353551
TL;DR: BAS 03353551 (CAS 1005068-69-8) is a chemical compound with molecular formula C17H15F3N2O3S and molecular weight 384.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-5-(4-methylbenzoyl)-6-thiophen-2-yl-4-(trifluoromethyl)-1,3-diazinan-2-one
Also Known As: BAS 03353551, 4-hydroxy-5-(4-methylbenzoyl)-6-thien-2-yl-4-(trifluoromethyl)tetrahydropyrimidin-2(1H)-one, 4-hydroxy-5-(4-methylbenzoyl)-6-thiophen-2-yl-4-(trifluoromethyl)-1,3-diazinan-2-one, [2,4-dihydroxy-6-(thiophen-2-yl)-4-(trifluoromethyl)-1,4,5,6-tetrahydropyrimidin-5-yl](4-methylphenyl)methanone, 4-HYDROXY-5-(4-METHYLBENZOYL)-6-(THIOPHEN-2-YL)-4-(TRIFLUOROMETHYL)-1,3-DIAZINAN-2-ONE
| Molecular Formula | C17H15F3N2O3S |
|---|---|
| Molecular Weight | 384.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.07556 |
| Heavy Atoms | 26 |
| Complexity | 566.0 |
Chemical Identifiers
| CAS Number | 1005068-69-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)C2C(NC(=O)NC2(C(F)(F)F)O)C3=CC=CS3 |
| InChIKey | UCMYEYOMPOHFNP-UHFFFAOYSA-N |
Product Overview
BAS 03353551 (CAS 1005068-69-8), with molecular formula C17H15F3N2O3S and molecular weight 384.08 g/mol. IUPAC: 4-hydroxy-5-(4-methylbenzoyl)-6-thiophen-2-yl-4-(trifluoromethyl)-1,3-diazinan-2-one.
Chemical Property Profile of BAS 03353551
Property Insights of BAS 03353551
The XLogP value of 3.1 indicates that BAS 03353551 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03353551. Following Lipinski's Rule of Five, BAS 03353551 has 3 hydrogen bond donor(s) and 7 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 03353551?
The CAS number of BAS 03353551 is 1005068-69-8.
What is the molecular formula of BAS 03353551?
The molecular formula of BAS 03353551 is C17H15F3N2O3S.
What is the molecular weight of BAS 03353551?
The molecular weight of BAS 03353551 is 384.08 g/mol.
Where can I buy BAS 03353551?
You can request a quote for BAS 03353551 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03353551?
Yes, KEHONG BIO provides custom synthesis services for BAS 03353551 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.