(S)-Dibenzyl 2-aminopentanedioate hydrochloride
TL;DR: (S)-Dibenzyl 2-aminopentanedioate hydrochloride (CAS 4561-10-8) is a chemical compound with molecular formula C19H22ClNO4 and molecular weight 363.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibenzyl (2S)-2-aminopentanedioate;hydrochloride
Also Known As: H-Glu(OBzl)-OBzl.HCl, Dibenzyl L-Glutamate Hydrochloride, (S)-Dibenzyl 2-aminopentanedioate hydrochloride, H-GLU(OBZL)-OBZL HCL, H-Glu-Obzl HCl
| Molecular Formula | C19H22ClNO4 |
|---|---|
| Molecular Weight | 363.12 g/mol |
| LogP | 3.0025 |
| Topological Polar Surface Area | 78.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 363.12375 |
| Heavy Atoms | 25 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 4561-10-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)CC[C@@H](C(=O)OCC2=CC=CC=C2)N.Cl |
| InChIKey | GRGJVECUQLAEDM-LMOVPXPDSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(S)-Dibenzyl 2-aminopentanedioate hydrochloride (CAS 4561-10-8), with molecular formula C19H22ClNO4 and molecular weight 363.12 g/mol. IUPAC: dibenzyl (2S)-2-aminopentanedioate;hydrochloride.
Chemical Property Profile of (S)-Dibenzyl 2-aminopentanedioate hydrochloride
Property Insights of (S)-Dibenzyl 2-aminopentanedioate hydrochloride
The XLogP value of 3.0025 indicates that (S)-Dibenzyl 2-aminopentanedioate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-Dibenzyl 2-aminopentanedioate hydrochloride. Following Lipinski's Rule of Five, (S)-Dibenzyl 2-aminopentanedioate hydrochloride has 2 hydrogen bond donor(s) and 5 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 (S)-Dibenzyl 2-aminopentanedioate hydrochloride?
The CAS number of (S)-Dibenzyl 2-aminopentanedioate hydrochloride is 4561-10-8.
What is the molecular formula of (S)-Dibenzyl 2-aminopentanedioate hydrochloride?
The molecular formula of (S)-Dibenzyl 2-aminopentanedioate hydrochloride is C19H22ClNO4.
What is the molecular weight of (S)-Dibenzyl 2-aminopentanedioate hydrochloride?
The molecular weight of (S)-Dibenzyl 2-aminopentanedioate hydrochloride is 363.12 g/mol.
Where can I buy (S)-Dibenzyl 2-aminopentanedioate hydrochloride?
You can request a quote for (S)-Dibenzyl 2-aminopentanedioate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-Dibenzyl 2-aminopentanedioate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for (S)-Dibenzyl 2-aminopentanedioate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.