BAS 02078575
TL;DR: BAS 02078575 (CAS 333443-63-3) is a chemical compound with molecular formula C23H23NO5S and molecular weight 425.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3,4-dimethylphenyl)-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoate
Also Known As: BAS 02078575, 2-(3,4-dimethylphenyl)-2-oxoethyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanoate, [2-(3,4-dimethylphenyl)-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoate, 2-(3,4-Dimethylphenyl)-2-oxoethyl 2-(1,3-dioxoisoindolin-2-yl)-4-(methylthio)butanoate, 2-(3,4-dimethylphenyl)-2-oxoethyl 2-(1,3-dioxobenzo[c]azolin-2-yl)-4-methylthi obutanoate
| Molecular Formula | C23H23NO5S |
|---|---|
| Molecular Weight | 425.13 g/mol |
| LogP | 3.44724 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 425.1297 |
| Heavy Atoms | 30 |
| Complexity | 981.4031 |
Chemical Identifiers
| CAS Number | 333443-63-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)COC(=O)C(CCSC)N2C(=O)C3=CC=CC=C3C2=O)C |
Product Overview
BAS 02078575 (CAS 333443-63-3), with molecular formula C23H23NO5S and molecular weight 425.13 g/mol. IUPAC: [2-(3,4-dimethylphenyl)-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanoate.
Chemical Property Profile of BAS 02078575
Property Insights of BAS 02078575
The XLogP value of 3.44724 indicates that BAS 02078575 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02078575. Following Lipinski's Rule of Five, BAS 02078575 has 0 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 BAS 02078575?
The CAS number of BAS 02078575 is 333443-63-3.
What is the molecular formula of BAS 02078575?
The molecular formula of BAS 02078575 is C23H23NO5S.
What is the molecular weight of BAS 02078575?
The molecular weight of BAS 02078575 is 425.13 g/mol.
Where can I buy BAS 02078575?
You can request a quote for BAS 02078575 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02078575?
Yes, KEHONG BIO provides custom synthesis services for BAS 02078575 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.