RefChem:305306
TL;DR: RefChem:305306 (CAS 34144-31-5) is a chemical compound with molecular formula C19H22N2O3 and molecular weight 326.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl 2-hydroxy-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaene-2-carboxylate
Also Known As: 5H-Benzo(4,5)cyclohepta(1,2-b)pyridine-5-carboxylic acid, 10,11-dihydro-5-hydroxy-, 2-(dimethylamino)ethyl ester, 2-(Dimethylamino)ethyl 5-hydroxy-10,11-dihydro-5H-benzo[4,5]cyclohepta[1,2-b]pyridine-5-carboxylate, BRN 0443539, RefChem:305306
| Molecular Formula | C19H22N2O3 |
|---|---|
| Molecular Weight | 326.16 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.16306 |
| Heavy Atoms | 24 |
| Complexity | 442.0 |
Chemical Identifiers
| CAS Number | 34144-31-5 |
|---|---|
| SMILES | CN(C)CCOC(=O)C1(C2=C(CCC3=CC=CC=C31)N=CC=C2)O |
| InChIKey | TYJPWISBRRQRBC-UHFFFAOYSA-N |
Product Overview
RefChem:305306 (CAS 34144-31-5), with molecular formula C19H22N2O3 and molecular weight 326.16 g/mol. IUPAC: 2-(dimethylamino)ethyl 2-hydroxy-7-azatricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaene-2-carboxylate.
Chemical Property Profile of RefChem:305306
Property Insights of RefChem:305306
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:305306. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:305306. Following Lipinski's Rule of Five, RefChem:305306 has 1 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 RefChem:305306?
The CAS number of RefChem:305306 is 34144-31-5.
What is the molecular formula of RefChem:305306?
The molecular formula of RefChem:305306 is C19H22N2O3.
What is the molecular weight of RefChem:305306?
The molecular weight of RefChem:305306 is 326.16 g/mol.
Where can I buy RefChem:305306?
You can request a quote for RefChem:305306 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:305306?
Yes, KEHONG BIO provides custom synthesis services for RefChem:305306 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.