RefChem:1085138
TL;DR: RefChem:1085138 (CAS 15475-49-7) is a chemical compound with molecular formula C23H26ClNO5 and molecular weight 431.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethyl-dimethylazanium;(Z)-4-hydroxy-4-oxobut-2-enoate
Also Known As: 3-Chloro-5-(2-(dimethylamino)ethoxy)-10,11-dihydro-5H-dibenzo(a,d)cycloheptene maleate, Ethylamine, 2-((10,11-dihydro-3-chloro-5H-dibenzo(a,d)cyclohepten-5-yl)oxy)-N,N-dimethyl-, maleate (1:1), ETHYLAMINE, 2-((10,11-DIHYDRO-3-CHLORO-5H-DIBENZO(a,d)CYCLOHEPTEN-5-YL)OXY)-N,N-, RefChem:1085138
| Molecular Formula | C23H26ClNO5 |
|---|---|
| Molecular Weight | 431.15 g/mol |
| LogP | 1.0662 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.14996 |
| Heavy Atoms | 30 |
| Complexity | 894.2165 |
Chemical Identifiers
| CAS Number | 15475-49-7 |
|---|---|
| SMILES | C[NH+](C)CCOC1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl.C(=C\C(=O)[O-])\C(=O)O |
Product Overview
RefChem:1085138 (CAS 15475-49-7), with molecular formula C23H26ClNO5 and molecular weight 431.15 g/mol. IUPAC: 2-[(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenyl)oxy]ethyl-dimethylazanium;(Z)-4-hydroxy-4-oxobut-2-enoate.
Chemical Property Profile of RefChem:1085138
Property Insights of RefChem:1085138
The XLogP value of 1.0662 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1085138. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1085138. Following Lipinski's Rule of Five, RefChem:1085138 has 2 hydrogen bond donor(s) and 4 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:1085138?
The CAS number of RefChem:1085138 is 15475-49-7.
What is the molecular formula of RefChem:1085138?
The molecular formula of RefChem:1085138 is C23H26ClNO5.
What is the molecular weight of RefChem:1085138?
The molecular weight of RefChem:1085138 is 431.15 g/mol.
Where can I buy RefChem:1085138?
You can request a quote for RefChem:1085138 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1085138?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1085138 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.