Boc-Cys(Bzl)-Ser-OMe
TL;DR: Boc-Cys(Bzl)-Ser-OMe (CAS 13512-53-3) is a chemical compound with molecular formula C19H28N2O6S and molecular weight 412.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[[(2R)-3-benzylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-hydroxypropanoate
Also Known As: Boc-Cys(Bzl)-Ser-OMe, BOC-L-CYSTEINE-BENZYL SERINE METHYL ESTER, 512B533, methyl (2S)-2-[[(2R)-3-benzylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-hydroxypropanoate, L-Serine,N-[N-[(1,1-dimethylethoxy)carbonyl]-S-(phenylmethyl)-L-cysteinyl]-, methylester (9CI)
| Molecular Formula | C19H28N2O6S |
|---|---|
| Molecular Weight | 412.17 g/mol |
| LogP | 1.4632 |
| Topological Polar Surface Area | 113.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 412.1668 |
| Heavy Atoms | 28 |
| Complexity | 647.574 |
Chemical Identifiers
| CAS Number | 13512-53-3 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](CSCC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)OC |
Product Overview
Boc-Cys(Bzl)-Ser-OMe (CAS 13512-53-3), with molecular formula C19H28N2O6S and molecular weight 412.17 g/mol. IUPAC: methyl (2S)-2-[[(2R)-3-benzylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoyl]amino]-3-hydroxypropanoate.
Chemical Property Profile of Boc-Cys(Bzl)-Ser-OMe
Property Insights of Boc-Cys(Bzl)-Ser-OMe
The XLogP value of 1.4632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-Cys(Bzl)-Ser-OMe. The TPSA of 113.96 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-Cys(Bzl)-Ser-OMe. Following Lipinski's Rule of Five, Boc-Cys(Bzl)-Ser-OMe 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 Boc-Cys(Bzl)-Ser-OMe?
The CAS number of Boc-Cys(Bzl)-Ser-OMe is 13512-53-3.
What is the molecular formula of Boc-Cys(Bzl)-Ser-OMe?
The molecular formula of Boc-Cys(Bzl)-Ser-OMe is C19H28N2O6S.
What is the molecular weight of Boc-Cys(Bzl)-Ser-OMe?
The molecular weight of Boc-Cys(Bzl)-Ser-OMe is 412.17 g/mol.
Where can I buy Boc-Cys(Bzl)-Ser-OMe?
You can request a quote for Boc-Cys(Bzl)-Ser-OMe directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-Cys(Bzl)-Ser-OMe?
Yes, KEHONG BIO provides custom synthesis services for Boc-Cys(Bzl)-Ser-OMe and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.