N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine
TL;DR: N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine (CAS 78196-39-1) is a chemical compound with molecular formula C17H16N6O4S2 and molecular weight 432.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-[[2-[(4-azidobenzoyl)amino]acetyl]amino]-3-(pyridin-2-yldisulfanyl)propanoic acid
Also Known As: AGTC, N-(4-Azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine, (2R)-2-[[2-[(4-azidobenzoyl)amino]acetyl]amino]-3-(pyridin-2-yldisulfanyl)propanoic acid, L-Alanine, N-(N-(4-azidobenzoyl)glycyl)-3-(2-pyridinyldithio)-, N-(4-Azidobenzoyl)glycyl-3-[(pyridin-2-yl)disulfanyl]-L-alanine
| Molecular Formula | C17H16N6O4S2 |
|---|---|
| Molecular Weight | 432.07 g/mol |
| LogP | 2.7631 |
| Topological Polar Surface Area | 157.15 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 432.06744 |
| Heavy Atoms | 29 |
| Complexity | 903.8989 |
Chemical Identifiers
| CAS Number | 78196-39-1 |
|---|---|
| SMILES | C1=CC=NC(=C1)SSC[C@@H](C(=O)O)NC(=O)CNC(=O)C2=CC=C(C=C2)N=[N+]=[N-] |
Product Overview
N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine (CAS 78196-39-1), with molecular formula C17H16N6O4S2 and molecular weight 432.07 g/mol. IUPAC: (2R)-2-[[2-[(4-azidobenzoyl)amino]acetyl]amino]-3-(pyridin-2-yldisulfanyl)propanoic acid.
Chemical Property Profile of N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine
Property Insights of N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine
The XLogP value of 2.7631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine. The TPSA of 157.15 Ų indicates high polarity, suggesting N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine has 3 hydrogen bond donor(s) and 7 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 N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine?
The CAS number of N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine is 78196-39-1.
What is the molecular formula of N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine?
The molecular formula of N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine is C17H16N6O4S2.
What is the molecular weight of N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine?
The molecular weight of N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine is 432.07 g/mol.
Where can I buy N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine?
You can request a quote for N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-azidobenzoylglycyl)-S-(2-thiopyridyl)cysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.