RefChem:1073437
TL;DR: RefChem:1073437 (CAS 17929-92-9) is a chemical compound with molecular formula C23H32N2O4 and molecular weight 400.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[2-(7,8,9,10-tetrahydro-6H-cyclohepta[b]indol-5-yl)ethyl]azanium;(E)-4-hydroxy-4-oxobut-2-enoate
Also Known As: 5H-Cyclohept(b)indole, 5,6,7,8,9,10-hexahydro-5-(2-(diethylamino)ethyl)-, fumarate (1:1), 5,6,7,8,9,10-Hexahydro-5-(2-(diethylamino)ethyl)-5H-cyclohept(b)indole fumarate, diethyl-[2-(7,8,9,10-tetrahydro-6H-cyclohepta[b]indol-5-yl)ethyl]azanium; (E)-4-hydroxy-4-oxobut-2-enoate, RefChem:1073437
| Molecular Formula | C23H32N2O4 |
|---|---|
| Molecular Weight | 400.24 g/mol |
| LogP | 1.212 |
| Topological Polar Surface Area | 86.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 400.2362 |
| Heavy Atoms | 29 |
| Complexity | 833.92505 |
Chemical Identifiers
| CAS Number | 17929-92-9 |
|---|---|
| SMILES | CC[NH+](CC)CCN1C2=C(CCCCC2)C3=CC=CC=C31.C(=C/C(=O)[O-])\C(=O)O |
Product Overview
RefChem:1073437 (CAS 17929-92-9), with molecular formula C23H32N2O4 and molecular weight 400.24 g/mol. IUPAC: diethyl-[2-(7,8,9,10-tetrahydro-6H-cyclohepta[b]indol-5-yl)ethyl]azanium;(E)-4-hydroxy-4-oxobut-2-enoate.
Chemical Property Profile of RefChem:1073437
Property Insights of RefChem:1073437
The XLogP value of 1.212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1073437. The TPSA of 86.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1073437. Following Lipinski's Rule of Five, RefChem:1073437 has 2 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 RefChem:1073437?
The CAS number of RefChem:1073437 is 17929-92-9.
What is the molecular formula of RefChem:1073437?
The molecular formula of RefChem:1073437 is C23H32N2O4.
What is the molecular weight of RefChem:1073437?
The molecular weight of RefChem:1073437 is 400.24 g/mol.
Where can I buy RefChem:1073437?
You can request a quote for RefChem:1073437 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1073437?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1073437 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.