BAS 04392301
TL;DR: BAS 04392301 (CAS 457640-39-0) is a chemical compound with molecular formula C19H25N3OS2 and molecular weight 375.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylpiperidin-1-yl)-2-[(7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone
Also Known As: BAS 04392301, AF-399/40923335, 2-((7-methyl-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)-1-(4-methylpiperidin-1-yl)ethanone, F1174-3180, 1-(4-methylpiperidin-1-yl)-2-[(7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone
| Molecular Formula | C19H25N3OS2 |
|---|---|
| Molecular Weight | 375.14 g/mol |
| LogP | 4.1667 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.1439 |
| Heavy Atoms | 25 |
| Complexity | 780.3123 |
Chemical Identifiers
| CAS Number | 457640-39-0 |
|---|---|
| SMILES | CC1CCN(CC1)C(=O)CSC2=NC=NC3=C2C4=C(S3)CC(CC4)C |
Product Overview
BAS 04392301 (CAS 457640-39-0), with molecular formula C19H25N3OS2 and molecular weight 375.14 g/mol. IUPAC: 1-(4-methylpiperidin-1-yl)-2-[(7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone.
Chemical Property Profile of BAS 04392301
Property Insights of BAS 04392301
The XLogP value of 4.1667 indicates that BAS 04392301 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.09 Ų, BAS 04392301 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04392301 has 0 hydrogen bond donor(s) and 5 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 04392301?
The CAS number of BAS 04392301 is 457640-39-0.
What is the molecular formula of BAS 04392301?
The molecular formula of BAS 04392301 is C19H25N3OS2.
What is the molecular weight of BAS 04392301?
The molecular weight of BAS 04392301 is 375.14 g/mol.
Where can I buy BAS 04392301?
You can request a quote for BAS 04392301 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04392301?
Yes, KEHONG BIO provides custom synthesis services for BAS 04392301 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.