BAS 04894309
TL;DR: BAS 04894309 (CAS 1165803-85-9) is a chemical compound with molecular formula C23H30N2O3S and molecular weight 414.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-methylsulfanyl-1-oxo-1-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]butan-2-yl]isoindole-1,3-dione
Also Known As: BAS 04894309, 2-(4-(methylthio)-1-oxo-1-((1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)butan-2-yl)isoindoline-1,3-dione, 2-[3-Methylsulfanyl-1-((1S,5R)-1,3,3-trimethyl-6-aza-bicyclo[3.2.1]octane-6-carbonyl)-propyl]-isoindole- 1,3-dione
| Molecular Formula | C23H30N2O3S |
|---|---|
| Molecular Weight | 414.20 g/mol |
| LogP | 3.8315 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.19772 |
| Heavy Atoms | 29 |
| Complexity | 832.43384 |
Chemical Identifiers
| CAS Number | 1165803-85-9 |
|---|---|
| SMILES | C[C@@]12C[C@@H](CC(C1)(C)C)N(C2)C(=O)C(CCSC)N3C(=O)C4=CC=CC=C4C3=O |
Product Overview
BAS 04894309 (CAS 1165803-85-9), with molecular formula C23H30N2O3S and molecular weight 414.20 g/mol. IUPAC: 2-[4-methylsulfanyl-1-oxo-1-[(1S,5R)-1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl]butan-2-yl]isoindole-1,3-dione.
Chemical Property Profile of BAS 04894309
Property Insights of BAS 04894309
The XLogP value of 3.8315 indicates that BAS 04894309 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.69 Ų, BAS 04894309 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04894309 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 04894309?
The CAS number of BAS 04894309 is 1165803-85-9.
What is the molecular formula of BAS 04894309?
The molecular formula of BAS 04894309 is C23H30N2O3S.
What is the molecular weight of BAS 04894309?
The molecular weight of BAS 04894309 is 414.20 g/mol.
Where can I buy BAS 04894309?
You can request a quote for BAS 04894309 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04894309?
Yes, KEHONG BIO provides custom synthesis services for BAS 04894309 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.