RefChem:313491
TL;DR: RefChem:313491 (CAS 38865-09-7) is a chemical compound with molecular formula C33H48Cl2N2O5 and molecular weight 622.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[7-[5-(diethylazaniumyl)pentan-2-yloxycarbonyl]-9-oxofluorene-2-carbonyl]oxypentyl-diethylazanium dichloride
Also Known As: C33H46N2O5.2ClH.1/3H2O, C33-H46-N2-O5.2Cl-H.1/3H2-O, 9H-Fluorene-2,7-dicarboxylic acid, 9-oxo-, bis(4-(diethylamino)-1-methylbutyl) ester, hydrochloride, hydrate (3:6:1), 4-[7-[5-(diethylazaniumyl)pentan-2-yloxycarbonyl]-9-oxofluorene-2-carbonyl]oxypentyl-diethylazanium dichloride, 9H-FLUORENE-2,7-DICARBOXYLIC ACID, 9-OXO-, BIS(4-(DIETHYLAMINO)-1-METHYLBUTYL) E
| Molecular Formula | C33H48Cl2N2O5 |
|---|---|
| Molecular Weight | 622.29 g/mol |
| LogP | -2.59 |
| Topological Polar Surface Area | 78.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 18 |
| Exact Mass | 622.294 |
| Heavy Atoms | 42 |
| Complexity | 747.0 |
Chemical Identifiers
| CAS Number | 38865-09-7 |
|---|---|
| SMILES | CC[NH+](CC)CCCC(C)OC(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)C(=O)OC(C)CCC[NH+](CC)CC.[Cl-].[Cl-] |
| InChIKey | SDRWLYVXCYBHTB-UHFFFAOYSA-N |
Product Overview
RefChem:313491 (CAS 38865-09-7), with molecular formula C33H48Cl2N2O5 and molecular weight 622.29 g/mol. IUPAC: 4-[7-[5-(diethylazaniumyl)pentan-2-yloxycarbonyl]-9-oxofluorene-2-carbonyl]oxypentyl-diethylazanium dichloride.
Chemical Property Profile of RefChem:313491
Property Insights of RefChem:313491
The XLogP value of -2.59 indicates that RefChem:313491 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:313491. Following Lipinski's Rule of Five, RefChem:313491 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:313491?
The CAS number of RefChem:313491 is 38865-09-7.
What is the molecular formula of RefChem:313491?
The molecular formula of RefChem:313491 is C33H48Cl2N2O5.
What is the molecular weight of RefChem:313491?
The molecular weight of RefChem:313491 is 622.29 g/mol.
Where can I buy RefChem:313491?
You can request a quote for RefChem:313491 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:313491?
Yes, KEHONG BIO provides custom synthesis services for RefChem:313491 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.