RefChem:261320
TL;DR: RefChem:261320 (CAS 15161-61-2) is a chemical compound with molecular formula C26H37NO5S and molecular weight 475.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-2-oxoacetate;methyl-[1-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]sulfanylpentan-3-yl]azanium
Also Known As: 2-Furanpropanethiol, tetrahydro-S-(2-diethylaminoethyl)-beta-(1-naphthylmethyl)-, oxalate, 1-Naphthalenepropanethiol, S-(2-diethylaminoethyl)-beta-(tetrahydrofurfuryl)-, oxalate, S-(2-Diethylaminoethyl)-beta-(tetrahydrofurfuryl)-1-naphthalenepropanethiol oxalate, 2-hydroxy-2-oxoacetate; methyl-[1-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]sulfanylpentan-3-yl]azanium, Ethanamine, N,N-diethyl-2-[[2-(1-naphthalenylmethyl)-3-(tetrahydro-2-furanyl)propyl]thio]-, ethanedioate (1:1)
| Molecular Formula | C26H37NO5S |
|---|---|
| Molecular Weight | 475.24 g/mol |
| LogP | 2.48 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 475.23926 |
| Heavy Atoms | 33 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 15161-61-2 |
|---|---|
| SMILES | CCC(CCSCC(CC1CCCO1)CC2=CC=CC3=CC=CC=C32)[NH2+]C.C(=O)(C(=O)[O-])O |
| InChIKey | FMXCXQKWRSLFLM-UHFFFAOYSA-N |
Product Overview
RefChem:261320 (CAS 15161-61-2), with molecular formula C26H37NO5S and molecular weight 475.24 g/mol. IUPAC: 2-hydroxy-2-oxoacetate;methyl-[1-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]sulfanylpentan-3-yl]azanium.
Chemical Property Profile of RefChem:261320
Property Insights of RefChem:261320
The XLogP value of 2.48 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:261320. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:261320. Following Lipinski's Rule of Five, RefChem:261320 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:261320?
The CAS number of RefChem:261320 is 15161-61-2.
What is the molecular formula of RefChem:261320?
The molecular formula of RefChem:261320 is C26H37NO5S.
What is the molecular weight of RefChem:261320?
The molecular weight of RefChem:261320 is 475.24 g/mol.
Where can I buy RefChem:261320?
You can request a quote for RefChem:261320 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:261320?
Yes, KEHONG BIO provides custom synthesis services for RefChem:261320 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.