![methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate structure](/static/products/7354/73548-85-3.webp)
methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate
TL;DR: methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate (CAS 73548-85-3) is a chemical compound with molecular formula C21H24N2O5S and molecular weight 416.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[3-benzylsulfanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetate
Also Known As: methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate, methyl 2-[[3-benzylsulfanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetate
| Molecular Formula | C21H24N2O5S |
|---|---|
| Molecular Weight | 416.14 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 12 |
| Exact Mass | 416.1406 |
| Heavy Atoms | 29 |
| Complexity | 519.0 |
Chemical Identifiers
| CAS Number | 73548-85-3 |
|---|---|
| SMILES | COC(=O)CNC(=O)C(CSCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2 |
| InChIKey | BMIPLIADQXLQDX-UHFFFAOYSA-N |
Product Overview
methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate (CAS 73548-85-3), with molecular formula C21H24N2O5S and molecular weight 416.14 g/mol. IUPAC: methyl 2-[[3-benzylsulfanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]acetate.
Chemical Property Profile of methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate
Property Insights of methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate. Following Lipinski's Rule of Five, methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate has 2 hydrogen bond donor(s) and 6 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 methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate?
The CAS number of methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate is 73548-85-3.
What is the molecular formula of methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate?
The molecular formula of methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate is C21H24N2O5S.
What is the molecular weight of methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate?
The molecular weight of methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate is 416.14 g/mol.
Where can I buy methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate?
You can request a quote for methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate?
Yes, KEHONG BIO provides custom synthesis services for methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylglycinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.