RefChem:203869
TL;DR: RefChem:203869 (CAS 35973-87-6) is a chemical compound with molecular formula C21H18N2OS and molecular weight 346.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-naphthalen-2-yl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: (1)Benzothieno(2,3-d)pyrimidin-4-one, 5,6,7,8-tetrahydro-2-methyl-3-(2-naphthyl)-, 2-Methyl-3-(2-naphthyl)-4-oxo-5,6-tetramethylenethieno(2,3-d)pyrimidine, 2-methyl-3-(naphthalen-2-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, 2-methyl-3-naphthalen-2-yl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 5,6,7,8-Tetrahydro-2-methyl-3-(2-naphthalenyl)[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C21H18N2OS |
|---|---|
| Molecular Weight | 346.11 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 346.11398 |
| Heavy Atoms | 25 |
| Complexity | 576.0 |
Chemical Identifiers
| CAS Number | 35973-87-6 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC5=CC=CC=C5C=C4 |
| InChIKey | OHDOQPWQQWAIDI-UHFFFAOYSA-N |
Product Overview
RefChem:203869 (CAS 35973-87-6), with molecular formula C21H18N2OS and molecular weight 346.11 g/mol. IUPAC: 2-methyl-3-naphthalen-2-yl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of RefChem:203869
Property Insights of RefChem:203869
The XLogP value of 4.9 indicates that RefChem:203869 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:203869. Following Lipinski's Rule of Five, RefChem:203869 has 0 hydrogen bond donor(s) and 3 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:203869?
The CAS number of RefChem:203869 is 35973-87-6.
What is the molecular formula of RefChem:203869?
The molecular formula of RefChem:203869 is C21H18N2OS.
What is the molecular weight of RefChem:203869?
The molecular weight of RefChem:203869 is 346.11 g/mol.
Where can I buy RefChem:203869?
You can request a quote for RefChem:203869 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:203869?
Yes, KEHONG BIO provides custom synthesis services for RefChem:203869 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.