RefChem:447633
TL;DR: RefChem:447633 (CAS 577700-25-5) is a chemical compound with molecular formula C22H24N2O3S2 and molecular weight 428.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-3-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: 2-((2-(4-Ethoxyphenyl)-2-oxoethyl)thio)-3-ethyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one, 2-{[2-(4-ETHOXYPHENYL)-2-OXOETHYL]SULFANYL}-3-ETHYL-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE, 2-((2-(4-ETHOXYPHENYL)-2-OXOETHYL)SULFANYL)-3-ETHYL-5,6,7,8-TETRAHYDRO(1)BENZOTHIENO(2,3-D)PYRIMIDIN-4(3H)-ONE, 2-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-3-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 2-[2-(4-ethoxyphenyl)-2-oxoethylthio]-3-ethyl-3,5,6,7,8-pentahydrobenzo[b]thio pheno[2,3-d]pyrimidin-4-one
| Molecular Formula | C22H24N2O3S2 |
|---|---|
| Molecular Weight | 428.12 g/mol |
| LogP | 4.7304 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 428.12283 |
| Heavy Atoms | 29 |
| Complexity | 1099.9282 |
Chemical Identifiers
| CAS Number | 577700-25-5 |
|---|---|
| SMILES | CCN1C(=O)C2=C(N=C1SCC(=O)C3=CC=C(C=C3)OCC)SC4=C2CCCC4 |
Product Overview
RefChem:447633 (CAS 577700-25-5), with molecular formula C22H24N2O3S2 and molecular weight 428.12 g/mol. IUPAC: 2-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-3-ethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of RefChem:447633
Property Insights of RefChem:447633
The XLogP value of 4.7304 indicates that RefChem:447633 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:447633. Following Lipinski's Rule of Five, RefChem:447633 has 0 hydrogen bond donor(s) and 6 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 RefChem:447633?
The CAS number of RefChem:447633 is 577700-25-5.
What is the molecular formula of RefChem:447633?
The molecular formula of RefChem:447633 is C22H24N2O3S2.
What is the molecular weight of RefChem:447633?
The molecular weight of RefChem:447633 is 428.12 g/mol.
Where can I buy RefChem:447633?
You can request a quote for RefChem:447633 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:447633?
Yes, KEHONG BIO provides custom synthesis services for RefChem:447633 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.