BOC-D-CYS-OH
TL;DR: BOC-D-CYS-OH (CAS 149281-64-1) is a chemical compound with molecular formula C14H11BrO4 and molecular weight 321.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2Z)-2-bromo-2-[5-(4-methylphenyl)-3-oxofuran-2-ylidene]acetate
Also Known As: BOC-D-CYS-OH, Acetic acid, bromo(5-(4-methylphenyl)-3-oxo-2(3H)-furanylidene)-, methyl ester, (Z)-, methyl (2Z)-2-bromo-2-[5-(4-methylphenyl)-3-oxofuran-2-ylidene]acetate, Methyl bromo(5-(4-methylphenyl)-3-oxo-2(3H)-furanylidene)acetate (Z)-, 2-[Bromo(methoxycarbonyl)methylene]-5-(4-methylphenyl)furan-3(2H)-one
| Molecular Formula | C14H11BrO4 |
|---|---|
| Molecular Weight | 321.98 g/mol |
| LogP | 2.71472 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 321.98407 |
| Heavy Atoms | 19 |
| Complexity | 596.3769 |
Chemical Identifiers
| CAS Number | 149281-64-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=CC(=O)/C(=C(\C(=O)OC)/Br)/O2 |
Product Overview
BOC-D-CYS-OH (CAS 149281-64-1), with molecular formula C14H11BrO4 and molecular weight 321.98 g/mol. IUPAC: methyl (2Z)-2-bromo-2-[5-(4-methylphenyl)-3-oxofuran-2-ylidene]acetate.
Chemical Property Profile of BOC-D-CYS-OH
Property Insights of BOC-D-CYS-OH
The XLogP value of 2.71472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BOC-D-CYS-OH. With a topological polar surface area (TPSA) of 52.6 Ų, BOC-D-CYS-OH exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BOC-D-CYS-OH has 0 hydrogen bond donor(s) and 4 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-D-CYS-OH?
The CAS number of BOC-D-CYS-OH is 149281-64-1.
What is the molecular formula of BOC-D-CYS-OH?
The molecular formula of BOC-D-CYS-OH is C14H11BrO4.
What is the molecular weight of BOC-D-CYS-OH?
The molecular weight of BOC-D-CYS-OH is 321.98 g/mol.
Where can I buy BOC-D-CYS-OH?
You can request a quote for BOC-D-CYS-OH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BOC-D-CYS-OH?
Yes, KEHONG BIO provides custom synthesis services for BOC-D-CYS-OH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.