BAS 00702853
TL;DR: BAS 00702853 (CAS 313378-57-3) is a chemical compound with molecular formula C24H28ClN3O4 and molecular weight 457.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-chlorophenyl)piperazin-1-yl]-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-2,5-dione
Also Known As: BAS 00702853, BIM-0037999.P001, 3-[4-(4-chlorophenyl)piperazin-1-yl]-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-2,5-dione, A1549/0067437, 3-[4-(4-chlorophenyl)-1-piperazinyl]-1-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-pyrrolidinedione
| Molecular Formula | C24H28ClN3O4 |
|---|---|
| Molecular Weight | 457.18 g/mol |
| LogP | 2.8494 |
| Topological Polar Surface Area | 62.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.17682 |
| Heavy Atoms | 32 |
| Complexity | 973.70966 |
Chemical Identifiers
| CAS Number | 313378-57-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=O)CC(C2=O)N3CCN(CC3)C4=CC=C(C=C4)Cl)OC |
Product Overview
BAS 00702853 (CAS 313378-57-3), with molecular formula C24H28ClN3O4 and molecular weight 457.18 g/mol. IUPAC: 3-[4-(4-chlorophenyl)piperazin-1-yl]-1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-2,5-dione.
Chemical Property Profile of BAS 00702853
Property Insights of BAS 00702853
The XLogP value of 2.8494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00702853. The TPSA of 62.32 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00702853. Following Lipinski's Rule of Five, BAS 00702853 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 00702853?
The CAS number of BAS 00702853 is 313378-57-3.
What is the molecular formula of BAS 00702853?
The molecular formula of BAS 00702853 is C24H28ClN3O4.
What is the molecular weight of BAS 00702853?
The molecular weight of BAS 00702853 is 457.18 g/mol.
Where can I buy BAS 00702853?
You can request a quote for BAS 00702853 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00702853?
Yes, KEHONG BIO provides custom synthesis services for BAS 00702853 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.