RefChem:825052
TL;DR: RefChem:825052 (CAS 578699-57-7) is a chemical compound with molecular formula C20H18BrF2N3O2S2 and molecular weight 513.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromo-4,6-difluorophenyl)-2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: Salor-int l413410-1ea, N-(2-Bromo-4,6-difluorophenyl)-2-((3-ethyl-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide, N-(2-bromo-4,6-difluorophenyl)-2-[(3-ethyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide, 638-195-5, N-(2-BROMO-4,6-DIFLUOROPHENYL)-2-((3-ETHYL-4-OXO-3,4,5,6,7,8-HEXAHYDRO(1)BENZOTHIENO(2,3-D)PYRIMIDIN-2-YL)SULFANYL)ACETAMIDE
| Molecular Formula | C20H18BrF2N3O2S2 |
|---|---|
| Molecular Weight | 513.00 g/mol |
| LogP | 5.1282 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 512.9992 |
| Heavy Atoms | 30 |
| Complexity | 1185.9553 |
Chemical Identifiers
| CAS Number | 578699-57-7 |
|---|---|
| SMILES | CCN1C(=O)C2=C(N=C1SCC(=O)NC3=C(C=C(C=C3Br)F)F)SC4=C2CCCC4 |
Product Overview
RefChem:825052 (CAS 578699-57-7), with molecular formula C20H18BrF2N3O2S2 and molecular weight 513.00 g/mol. IUPAC: N-(2-bromo-4,6-difluorophenyl)-2-[(3-ethyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of RefChem:825052
Property Insights of RefChem:825052
The XLogP value of 5.1282 indicates that RefChem:825052 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:825052. Following Lipinski's Rule of Five, RefChem:825052 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 RefChem:825052?
The CAS number of RefChem:825052 is 578699-57-7.
What is the molecular formula of RefChem:825052?
The molecular formula of RefChem:825052 is C20H18BrF2N3O2S2.
What is the molecular weight of RefChem:825052?
The molecular weight of RefChem:825052 is 513.00 g/mol.
Where can I buy RefChem:825052?
You can request a quote for RefChem:825052 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:825052?
Yes, KEHONG BIO provides custom synthesis services for RefChem:825052 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.