RefChem:448093
TL;DR: RefChem:448093 (CAS 372087-98-4) is a chemical compound with molecular formula C19H19N3O3S2 and molecular weight 401.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide
Also Known As: SALOR-INT L244414-1EA, 2-{[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide, 2-((3-(4-Methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide, 2-((3-(4-METHOXYPHENYL)-4-OXO-3,4,5,6,7,8-HEXAHYDRO(1)BENZOTHIENO(2,3-D)PYRIMIDIN-2-YL)SULFANYL)ACETAMIDE, 2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide
| Molecular Formula | C19H19N3O3S2 |
|---|---|
| Molecular Weight | 401.09 g/mol |
| LogP | 2.912 |
| Topological Polar Surface Area | 87.21 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.0868 |
| Heavy Atoms | 27 |
| Complexity | 1070.4788 |
Chemical Identifiers
| CAS Number | 372087-98-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)N)SC4=C3CCCC4 |
Product Overview
RefChem:448093 (CAS 372087-98-4), with molecular formula C19H19N3O3S2 and molecular weight 401.09 g/mol. IUPAC: 2-[[3-(4-methoxyphenyl)-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of RefChem:448093
Property Insights of RefChem:448093
The XLogP value of 2.912 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:448093. The TPSA of 87.21 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:448093. Following Lipinski's Rule of Five, RefChem:448093 has 1 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:448093?
The CAS number of RefChem:448093 is 372087-98-4.
What is the molecular formula of RefChem:448093?
The molecular formula of RefChem:448093 is C19H19N3O3S2.
What is the molecular weight of RefChem:448093?
The molecular weight of RefChem:448093 is 401.09 g/mol.
Where can I buy RefChem:448093?
You can request a quote for RefChem:448093 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:448093?
Yes, KEHONG BIO provides custom synthesis services for RefChem:448093 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.