BAS 00700367
TL;DR: BAS 00700367 (CAS 330181-86-7) is a chemical compound with molecular formula C17H22N2OS2 and molecular weight 334.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyclohexyl-2-methylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
Also Known As: BAS 00700367, 3-cyclohexyl-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one, AJ-292/11386114, 3-cyclohexyl-2-methylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one, 3-cyclohexyl-2-(methylthio)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4(3H)-one
| Molecular Formula | C17H22N2OS2 |
|---|---|
| Molecular Weight | 334.12 g/mol |
| LogP | 4.5639 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 334.11737 |
| Heavy Atoms | 22 |
| Complexity | 756.0852 |
Chemical Identifiers
| CAS Number | 330181-86-7 |
|---|---|
| SMILES | CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4CCCCC4 |
Product Overview
BAS 00700367 (CAS 330181-86-7), with molecular formula C17H22N2OS2 and molecular weight 334.12 g/mol. IUPAC: 3-cyclohexyl-2-methylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one.
Chemical Property Profile of BAS 00700367
Property Insights of BAS 00700367
The XLogP value of 4.5639 indicates that BAS 00700367 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.89 Ų, BAS 00700367 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00700367 has 0 hydrogen bond donor(s) and 4 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 BAS 00700367?
The CAS number of BAS 00700367 is 330181-86-7.
What is the molecular formula of BAS 00700367?
The molecular formula of BAS 00700367 is C17H22N2OS2.
What is the molecular weight of BAS 00700367?
The molecular weight of BAS 00700367 is 334.12 g/mol.
Where can I buy BAS 00700367?
You can request a quote for BAS 00700367 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00700367?
Yes, KEHONG BIO provides custom synthesis services for BAS 00700367 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.