L-786392
TL;DR: L-786392 (CAS 198472-47-8) is a chemical compound with molecular formula C31H38ClN5O7S and molecular weight 659.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,5R,6S)-3-[[9-[2-[4-(2-amino-2-oxoethyl)-1,4-diazoniabicyclo[2.2.2]octan-1-yl]ethyl]-2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(12),4,6,8,10-pentaen-3-yl]methyl]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate chloride
Also Known As: L 786392, L-786392, L-786,392, 1,4-Diazoniabicyclo(2.2.2)octane, 1-(2-amino-2-oxoethyl)-4-(2-(2-(((4S,5R,6S)-2-carboxy-6-((1R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo(3.2.0)hept-2-en-3-yl)methyl)-1,1-dioxido-2H-naphth(1,8-cd)isothiazol-6-yl)ethyl)-, inner salt, chloride, (4S,5R,6S)-3-[[9-[2-[4-(2-Amino-2-oxoethyl)-1,4-diazoniabicyclo[2.2.2]octan-1-yl]ethyl]-2,2-dioxo-2lambda6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(12),4,6,8,10-pentaen-3-yl]methyl]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate;chloride
| Molecular Formula | C31H38ClN5O7S |
|---|---|
| Molecular Weight | 659.22 g/mol |
| LogP | -4.0974 |
| Topological Polar Surface Area | 161.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 659.218 |
| Heavy Atoms | 45 |
| Complexity | 1752.0404 |
Chemical Identifiers
| CAS Number | 198472-47-8 |
|---|---|
| SMILES | C[C@@H]1[C@@H]2[C@H](C(=O)N2C(=C1CN3C4=CC=CC5=C(C=CC(=C54)S3(=O)=O)CC[N+]67CC[N+](CC6)(CC7)CC(=O)N)C(=O)[O-])[C@@H](C)O.[Cl-] |
Product Overview
L-786392 (CAS 198472-47-8), with molecular formula C31H38ClN5O7S and molecular weight 659.22 g/mol. IUPAC: (4S,5R,6S)-3-[[9-[2-[4-(2-amino-2-oxoethyl)-1,4-diazoniabicyclo[2.2.2]octan-1-yl]ethyl]-2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(12),4,6,8,10-pentaen-3-yl]methyl]-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate chloride.
Chemical Property Profile of L-786392
Property Insights of L-786392
The XLogP value of -4.0974 indicates that L-786392 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.14 Ų indicates high polarity, suggesting L-786392 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, L-786392 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 L-786392?
The CAS number of L-786392 is 198472-47-8.
What is the molecular formula of L-786392?
The molecular formula of L-786392 is C31H38ClN5O7S.
What is the molecular weight of L-786392?
The molecular weight of L-786392 is 659.22 g/mol.
Where can I buy L-786392?
You can request a quote for L-786392 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for L-786392?
Yes, KEHONG BIO provides custom synthesis services for L-786392 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.