RefChem:378210
TL;DR: RefChem:378210 (CAS 17606-23-4) is a chemical compound with molecular formula C22H29N3O5 and molecular weight 415.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(diethylamino)ethylcarbamoyl]-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid
Also Known As: 5-22-05-00599 (Beilstein Handbook Reference), Pyrrolo(2,1-a)isoquinoline-3-carboxylic acid, 5,6-dihydro-2-((2-(diethylamino)ethyl)carbamoyl)-8,9-dimethoxy-, 2-(2-diethylaminoethylcarbamoyl)-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid, 2-[[[2-(Diethylamino)ethyl]amino]carbonyl]-5,6-dihydro-8,9-dimethoxypyrrolo[2,1-a]isoquinoline-3-carboxylic acid, 2-{[2-(diethylamino)ethyl]carbamoyl}-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid
| Molecular Formula | C22H29N3O5 |
|---|---|
| Molecular Weight | 415.21 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 93.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 415.21072 |
| Heavy Atoms | 30 |
| Complexity | 599.0 |
Chemical Identifiers
| CAS Number | 17606-23-4 |
|---|---|
| SMILES | CCN(CC)CCNC(=O)C1=C(N2CCC3=CC(=C(C=C3C2=C1)OC)OC)C(=O)O |
| InChIKey | RDAQTRQJGTWCMP-UHFFFAOYSA-N |
Product Overview
RefChem:378210 (CAS 17606-23-4), with molecular formula C22H29N3O5 and molecular weight 415.21 g/mol. IUPAC: 2-[2-(diethylamino)ethylcarbamoyl]-8,9-dimethoxy-5,6-dihydropyrrolo[2,1-a]isoquinoline-3-carboxylic acid.
Chemical Property Profile of RefChem:378210
Property Insights of RefChem:378210
The XLogP value of -0.1 indicates that RefChem:378210 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:378210. Following Lipinski's Rule of Five, RefChem:378210 has 2 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 RefChem:378210?
The CAS number of RefChem:378210 is 17606-23-4.
What is the molecular formula of RefChem:378210?
The molecular formula of RefChem:378210 is C22H29N3O5.
What is the molecular weight of RefChem:378210?
The molecular weight of RefChem:378210 is 415.21 g/mol.
Where can I buy RefChem:378210?
You can request a quote for RefChem:378210 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:378210?
Yes, KEHONG BIO provides custom synthesis services for RefChem:378210 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.