BAS 00329652
TL;DR: BAS 00329652 (CAS 163769-85-5) is a chemical compound with molecular formula C21H24N2O5 and molecular weight 384.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,9-dimethoxy-5,5-dimethyl-1-(pyrrolidine-1-carbonyl)-6H-pyrrolo[2,1-a]isoquinoline-2,3-dione
Also Known As: BAS 00329652, 2,3-dimethoxy-6,6-dimethyl-10-(pyrrolidinylcarbonyl)-5,6,7-trihydroazolino[5,1 -a]isoquinoline-8,9-dione, 8,9-dimethoxy-5,5-dimethyl-1-(pyrrolidin-1-ylcarbonyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione, 8,9-dimethoxy-5,5-dimethyl-1-(pyrrolidine-1-carbonyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione, 8,9-dimethoxy-5,5-dimethyl-1-(pyrrolidine-1-carbonyl)-6H-pyrrolo[2,1-a]isoquinoline-2,3-dione
| Molecular Formula | C21H24N2O5 |
|---|---|
| Molecular Weight | 384.17 g/mol |
| LogP | 1.7833 |
| Topological Polar Surface Area | 76.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.16852 |
| Heavy Atoms | 28 |
| Complexity | 924.9688 |
Chemical Identifiers
| CAS Number | 163769-85-5 |
|---|---|
| SMILES | CC1(CC2=CC(=C(C=C2C3=C(C(=O)C(=O)N31)C(=O)N4CCCC4)OC)OC)C |
Product Overview
BAS 00329652 (CAS 163769-85-5), with molecular formula C21H24N2O5 and molecular weight 384.17 g/mol. IUPAC: 8,9-dimethoxy-5,5-dimethyl-1-(pyrrolidine-1-carbonyl)-6H-pyrrolo[2,1-a]isoquinoline-2,3-dione.
Chemical Property Profile of BAS 00329652
Property Insights of BAS 00329652
The XLogP value of 1.7833 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00329652. The TPSA of 76.15 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00329652. Following Lipinski's Rule of Five, BAS 00329652 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 00329652?
The CAS number of BAS 00329652 is 163769-85-5.
What is the molecular formula of BAS 00329652?
The molecular formula of BAS 00329652 is C21H24N2O5.
What is the molecular weight of BAS 00329652?
The molecular weight of BAS 00329652 is 384.17 g/mol.
Where can I buy BAS 00329652?
You can request a quote for BAS 00329652 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00329652?
Yes, KEHONG BIO provides custom synthesis services for BAS 00329652 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.