![2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one structure](/static/products/5903/590357-11-2.webp)
2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one
TL;DR: 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one (CAS 590357-11-2) is a chemical compound with molecular formula C23H20BrFN2O3S and molecular weight 502.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one
Also Known As: 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one, 2-[3-Bromo-5-methoxy-4-(1-methylethoxy)phenyl]-5-(4-fluorophenyl)-6-methylthieno[2,3-d]pyrimidin-4(1H)-one, 2-[3-bromo-5-methoxy-4-(propan-2-yloxy)phenyl]-5-(4-fluorophenyl)-6-methylthieno[2,3-d]pyrimidin-4(3H)-one, 2-(3-bromo-4-isopropoxy-5-methoxyphenyl)-5-(4-fluorophenyl)-6-methylthieno[2,3-d]pyrimidin-4(3H)-one, 2-[3-bromo-5-methoxy-4-(methylethoxy)phenyl]-5-(4-fluorophenyl)-6-methyl-3-hyd rothiopheno[2,3-d]pyrimidin-4-one
| Molecular Formula | C23H20BrFN2O3S |
|---|---|
| Molecular Weight | 502.04 g/mol |
| LogP | 6.32442 |
| Topological Polar Surface Area | 64.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 502.0362 |
| Heavy Atoms | 31 |
| Complexity | 1329.6471 |
Chemical Identifiers
| CAS Number | 590357-11-2 |
|---|---|
| SMILES | CC1=C(C2=C(S1)N=C(NC2=O)C3=CC(=C(C(=C3)Br)OC(C)C)OC)C4=CC=C(C=C4)F |
Product Overview
2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one (CAS 590357-11-2), with molecular formula C23H20BrFN2O3S and molecular weight 502.04 g/mol. IUPAC: 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one.
Chemical Property Profile of 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one
Property Insights of 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one
The XLogP value of 6.32442 indicates that 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one. Following Lipinski's Rule of Five, 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one?
The CAS number of 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one is 590357-11-2.
What is the molecular formula of 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one?
The molecular formula of 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one is C23H20BrFN2O3S.
What is the molecular weight of 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one?
The molecular weight of 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one is 502.04 g/mol.
Where can I buy 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one?
You can request a quote for 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.