BAS 00380621
TL;DR: BAS 00380621 (CAS 313493-34-4) is a chemical compound with molecular formula C28H32N4O4 and molecular weight 488.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[4-[4-(1,3-dioxoisoindol-2-yl)butyl]piperazin-1-yl]butyl]isoindole-1,3-dione
Also Known As: BAS 00380621, AE-641/32252028, 2,2'-(piperazine-1,4-diylbis(butane-4,1-diyl))bis(isoindoline-1,3-dione), 2-(4-{4-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butyl]-1-piperazinyl}butyl)-1H-isoindole-1,3(2H)-dione, 2,2'-(piperazine-1,4-diyldibutane-4,1-diyl)bis(1H-isoindole-1,3(2H)-dione)
| Molecular Formula | C28H32N4O4 |
|---|---|
| Molecular Weight | 488.24 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 81.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 488.24237 |
| Heavy Atoms | 36 |
| Complexity | 723.0 |
Chemical Identifiers
| CAS Number | 313493-34-4 |
|---|---|
| SMILES | C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3C2=O)CCCCN4C(=O)C5=CC=CC=C5C4=O |
| InChIKey | XTGNFFBHKJNVBJ-UHFFFAOYSA-N |
Product Overview
BAS 00380621 (CAS 313493-34-4), with molecular formula C28H32N4O4 and molecular weight 488.24 g/mol. IUPAC: 2-[4-[4-[4-(1,3-dioxoisoindol-2-yl)butyl]piperazin-1-yl]butyl]isoindole-1,3-dione.
Chemical Property Profile of BAS 00380621
Property Insights of BAS 00380621
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00380621. The TPSA of 81.2 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00380621. Following Lipinski's Rule of Five, BAS 00380621 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 00380621?
The CAS number of BAS 00380621 is 313493-34-4.
What is the molecular formula of BAS 00380621?
The molecular formula of BAS 00380621 is C28H32N4O4.
What is the molecular weight of BAS 00380621?
The molecular weight of BAS 00380621 is 488.24 g/mol.
Where can I buy BAS 00380621?
You can request a quote for BAS 00380621 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00380621?
Yes, KEHONG BIO provides custom synthesis services for BAS 00380621 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.