RefChem:1058767
TL;DR: RefChem:1058767 (CAS 67883-92-5) is a chemical compound with molecular formula C17H22N2O6S and molecular weight 382.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2,6-diaminohexanoic acid;4-hydroxy-3-[(E)-3-thiophen-2-ylprop-2-enoyl]-2H-furan-5-one
Also Known As: 2(5H)-Furanone, 3-hydroxy-4-(1-oxo-3-(2-thienyl)-2-propenyl)-, compd. with lysine (1:1), 3-Hydroxy-4-(1-oxo-3-(2-thienyl)-2-propenyl)-2(5H)-furanone compd. with lysine (1:1), (2S)-2,6-diaminohexanoic acid; 4-hydroxy-3-[(E)-3-thiophen-2-ylprop-2-enoyl]-2H-furan-5-one, RefChem:1058767
| Molecular Formula | C17H22N2O6S |
|---|---|
| Molecular Weight | 382.12 g/mol |
| LogP | 1.2266 |
| Topological Polar Surface Area | 152.94 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 382.11984 |
| Heavy Atoms | 26 |
| Complexity | 681.43506 |
Chemical Identifiers
| CAS Number | 67883-92-5 |
|---|---|
| SMILES | C1C(=C(C(=O)O1)O)C(=O)/C=C/C2=CC=CS2.C(CCN)C[C@@H](C(=O)O)N |
Product Overview
RefChem:1058767 (CAS 67883-92-5), with molecular formula C17H22N2O6S and molecular weight 382.12 g/mol. IUPAC: (2S)-2,6-diaminohexanoic acid;4-hydroxy-3-[(E)-3-thiophen-2-ylprop-2-enoyl]-2H-furan-5-one.
Chemical Property Profile of RefChem:1058767
Property Insights of RefChem:1058767
The XLogP value of 1.2266 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1058767. The TPSA of 152.94 Ų indicates high polarity, suggesting RefChem:1058767 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:1058767 has 4 hydrogen bond donor(s) and 8 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:1058767?
The CAS number of RefChem:1058767 is 67883-92-5.
What is the molecular formula of RefChem:1058767?
The molecular formula of RefChem:1058767 is C17H22N2O6S.
What is the molecular weight of RefChem:1058767?
The molecular weight of RefChem:1058767 is 382.12 g/mol.
Where can I buy RefChem:1058767?
You can request a quote for RefChem:1058767 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1058767?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1058767 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.