BAS 04085487
TL;DR: BAS 04085487 (CAS 433971-73-4) is a chemical compound with molecular formula C16H13Cl2N3O2S and molecular weight 381.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dichlorophenyl)-3-(4,6-dimethylpyrimidin-2-yl)sulfanylpyrrolidine-2,5-dione
Also Known As: BAS 04085487, 1-(3,4-dichlorophenyl)-3-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]pyrrolidine-2,5-dione, AJ-292/41080094, 1-(3,4-dichlorophenyl)-3-((4,6-dimethylpyrimidin-2-yl)thio)pyrrolidine-2,5-dione, 1-(3,4-dichlorophenyl)-3-(4,6-dimethylpyrimidin-2-yl)sulfanylpyrrolidine-2,5-dione
| Molecular Formula | C16H13Cl2N3O2S |
|---|---|
| Molecular Weight | 381.01 g/mol |
| LogP | 3.82444 |
| Topological Polar Surface Area | 63.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 381.01056 |
| Heavy Atoms | 24 |
| Complexity | 823.8174 |
Chemical Identifiers
| CAS Number | 433971-73-4 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)SC2CC(=O)N(C2=O)C3=CC(=C(C=C3)Cl)Cl)C |
Product Overview
BAS 04085487 (CAS 433971-73-4), with molecular formula C16H13Cl2N3O2S and molecular weight 381.01 g/mol. IUPAC: 1-(3,4-dichlorophenyl)-3-(4,6-dimethylpyrimidin-2-yl)sulfanylpyrrolidine-2,5-dione.
Chemical Property Profile of BAS 04085487
Property Insights of BAS 04085487
The XLogP value of 3.82444 indicates that BAS 04085487 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04085487. Following Lipinski's Rule of Five, BAS 04085487 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 04085487?
The CAS number of BAS 04085487 is 433971-73-4.
What is the molecular formula of BAS 04085487?
The molecular formula of BAS 04085487 is C16H13Cl2N3O2S.
What is the molecular weight of BAS 04085487?
The molecular weight of BAS 04085487 is 381.01 g/mol.
Where can I buy BAS 04085487?
You can request a quote for BAS 04085487 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04085487?
Yes, KEHONG BIO provides custom synthesis services for BAS 04085487 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.