5-S-cysteinyl-glycyl-dopa
TL;DR: 5-S-cysteinyl-glycyl-dopa (CAS 110823-49-9) is a chemical compound with molecular formula C14H19N3O7S and molecular weight 373.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-amino-3-[3-[(2R)-2-amino-3-(carboxymethylamino)-3-oxopropyl]sulfanyl-4,5-dihydroxyphenyl]propanoic acid
Also Known As: 5-S-Cysteinyl-glycyldopa, 5-S-Cysteinyl-glycyl-dopa, 5-S-Cysteinyl-glycine-dopa, (2S)-2-amino-3-[3-[(2R)-2-amino-3-(carboxymethylamino)-3-oxopropyl]sulfanyl-4,5-dihydroxyphenyl]propanoic acid, 3-({(2R)-2-Amino-3-[(carboxymethyl)imino]-3-hydroxypropyl}sulfanyl)-5-hydroxy-L-tyrosine
| Molecular Formula | C14H19N3O7S |
|---|---|
| Molecular Weight | 373.09 g/mol |
| LogP | -5.9 |
| Topological Polar Surface Area | 222.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 373.09436 |
| Heavy Atoms | 25 |
| Complexity | 493.0 |
Chemical Identifiers
| CAS Number | 110823-49-9 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)O)SC[C@@H](C(=O)NCC(=O)O)N)C[C@@H](C(=O)O)N |
| InChIKey | BEKGUNWQTPPXTG-YUMQZZPRSA-N |
Product Overview
5-S-cysteinyl-glycyl-dopa (CAS 110823-49-9), with molecular formula C14H19N3O7S and molecular weight 373.09 g/mol. IUPAC: (2S)-2-amino-3-[3-[(2R)-2-amino-3-(carboxymethylamino)-3-oxopropyl]sulfanyl-4,5-dihydroxyphenyl]propanoic acid.
Chemical Property Profile of 5-S-cysteinyl-glycyl-dopa
Property Insights of 5-S-cysteinyl-glycyl-dopa
The XLogP value of -5.9 indicates that 5-S-cysteinyl-glycyl-dopa is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 222.0 Ų indicates high polarity, suggesting 5-S-cysteinyl-glycyl-dopa may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-S-cysteinyl-glycyl-dopa has 7 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-S-cysteinyl-glycyl-dopa?
The CAS number of 5-S-cysteinyl-glycyl-dopa is 110823-49-9.
What is the molecular formula of 5-S-cysteinyl-glycyl-dopa?
The molecular formula of 5-S-cysteinyl-glycyl-dopa is C14H19N3O7S.
What is the molecular weight of 5-S-cysteinyl-glycyl-dopa?
The molecular weight of 5-S-cysteinyl-glycyl-dopa is 373.09 g/mol.
Where can I buy 5-S-cysteinyl-glycyl-dopa?
You can request a quote for 5-S-cysteinyl-glycyl-dopa directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-S-cysteinyl-glycyl-dopa?
Yes, KEHONG BIO provides custom synthesis services for 5-S-cysteinyl-glycyl-dopa and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.