RefChem:825068
TL;DR: RefChem:825068 (CAS 476484-24-9) is a chemical compound with molecular formula C25H21Br2N3O2S2 and molecular weight 616.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromo-4-methylphenyl)-2-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide
Also Known As: N-(2-Bromo-4-methylphenyl)-2-((3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide, N-(2-bromo-4-methylphenyl)-2-{[3-(4-bromophenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide, 648-732-5, N-(2-BROMO-4-METHYLPHENYL)-2-((3-(4-BROMOPHENYL)-4-OXO-3,4,5,6,7,8-HEXAHYDRO(1)BENZOTHIENO(2,3-D)PYRIMIDIN-2-YL)SULFANYL)ACETAMIDE, N-(2-bromo-4-methylphenyl)-2-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide
| Molecular Formula | C25H21Br2N3O2S2 |
|---|---|
| Molecular Weight | 616.94 g/mol |
| LogP | 6.89022 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 616.9442 |
| Heavy Atoms | 34 |
| Complexity | 1462.0352 |
Chemical Identifiers
| CAS Number | 476484-24-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=C(C=C5)Br)Br |
Product Overview
RefChem:825068 (CAS 476484-24-9), with molecular formula C25H21Br2N3O2S2 and molecular weight 616.94 g/mol. IUPAC: N-(2-bromo-4-methylphenyl)-2-[[3-(4-bromophenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of RefChem:825068
Property Insights of RefChem:825068
The XLogP value of 6.89022 indicates that RefChem:825068 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:825068. Following Lipinski's Rule of Five, RefChem:825068 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:825068?
The CAS number of RefChem:825068 is 476484-24-9.
What is the molecular formula of RefChem:825068?
The molecular formula of RefChem:825068 is C25H21Br2N3O2S2.
What is the molecular weight of RefChem:825068?
The molecular weight of RefChem:825068 is 616.94 g/mol.
Where can I buy RefChem:825068?
You can request a quote for RefChem:825068 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:825068?
Yes, KEHONG BIO provides custom synthesis services for RefChem:825068 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.