BAS 06671688
TL;DR: BAS 06671688 (CAS 345244-86-2) is a chemical compound with molecular formula C22H27N3O3 and molecular weight 381.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
Also Known As: BAS 06671688, 2-(2-(4-benzylpiperazin-1-yl)-2-oxoethyl)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione, 2-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione, 4-{2-oxo-2-[4-benzylpiperazinyl]ethyl}-4-azatricyclo[5.2.1.0<2,6>]decane-3,5-d ione, 4-[2-(4-BENZYLPIPERAZIN-1-YL)-2-OXOETHYL]-4-AZATRICYCLO[5.2.1.0(2),?]DECANE-3,5-DIONE
| Molecular Formula | C22H27N3O3 |
|---|---|
| Molecular Weight | 381.21 g/mol |
| LogP | 1.3619 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.20523 |
| Heavy Atoms | 28 |
| Complexity | 759.47656 |
Chemical Identifiers
| CAS Number | 345244-86-2 |
|---|---|
| SMILES | C1CC2CC1C3C2C(=O)N(C3=O)CC(=O)N4CCN(CC4)CC5=CC=CC=C5 |
Product Overview
BAS 06671688 (CAS 345244-86-2), with molecular formula C22H27N3O3 and molecular weight 381.21 g/mol. IUPAC: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione.
Chemical Property Profile of BAS 06671688
Property Insights of BAS 06671688
The XLogP value of 1.3619 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 06671688. The TPSA of 60.93 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06671688. Following Lipinski's Rule of Five, BAS 06671688 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 06671688?
The CAS number of BAS 06671688 is 345244-86-2.
What is the molecular formula of BAS 06671688?
The molecular formula of BAS 06671688 is C22H27N3O3.
What is the molecular weight of BAS 06671688?
The molecular weight of BAS 06671688 is 381.21 g/mol.
Where can I buy BAS 06671688?
You can request a quote for BAS 06671688 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06671688?
Yes, KEHONG BIO provides custom synthesis services for BAS 06671688 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.