ChemDiv1_024541
TL;DR: ChemDiv1_024541 (CAS 163769-84-4) is a chemical compound with molecular formula C19H20N2O3 and molecular weight 324.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,5-dimethyl-1-(pyrrolidine-1-carbonyl)-6H-pyrrolo[2,1-a]isoquinoline-2,3-dione
Also Known As: ChemDiv1_024541, BAS 00329649, 5,5-dimethyl-1-(pyrrolidin-1-ylcarbonyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione, 5,5-dimethyl-1-(pyrrolidine-1-carbonyl)-5,6-dihydropyrrolo[2,1-a]isoquinoline-2,3-dione, 5,5-dimethyl-1-(pyrrolidine-1-carbonyl)-6H-pyrrolo[2,1-a]isoquinoline-2,3-dione
| Molecular Formula | C19H20N2O3 |
|---|---|
| Molecular Weight | 324.15 g/mol |
| LogP | 1.7661 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 324.1474 |
| Heavy Atoms | 24 |
| Complexity | 800.58484 |
Chemical Identifiers
| CAS Number | 163769-84-4 |
|---|---|
| SMILES | CC1(CC2=CC=CC=C2C3=C(C(=O)C(=O)N31)C(=O)N4CCCC4)C |
Product Overview
ChemDiv1_024541 (CAS 163769-84-4), with molecular formula C19H20N2O3 and molecular weight 324.15 g/mol. IUPAC: 5,5-dimethyl-1-(pyrrolidine-1-carbonyl)-6H-pyrrolo[2,1-a]isoquinoline-2,3-dione.
Chemical Property Profile of ChemDiv1_024541
Property Insights of ChemDiv1_024541
The XLogP value of 1.7661 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_024541. With a topological polar surface area (TPSA) of 57.69 Ų, ChemDiv1_024541 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_024541 has 0 hydrogen bond donor(s) and 3 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 ChemDiv1_024541?
The CAS number of ChemDiv1_024541 is 163769-84-4.
What is the molecular formula of ChemDiv1_024541?
The molecular formula of ChemDiv1_024541 is C19H20N2O3.
What is the molecular weight of ChemDiv1_024541?
The molecular weight of ChemDiv1_024541 is 324.15 g/mol.
Where can I buy ChemDiv1_024541?
You can request a quote for ChemDiv1_024541 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_024541?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_024541 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.