比卡鲁胺硫醚
TL;DR: 比卡鲁胺硫醚 (CAS 90356-78-8) is a chemical compound with molecular formula C18H14F4N2O2S and molecular weight 398.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
比卡鲁胺硫醚
N-[4-cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenyl)sulfanyl-2-hydroxy-2-methylpropanamide
Also Known As: Bicalutamide Sulfide, N-(4-Cyano-3-(trifluoromethyl)phenyl)-3-((4-fluorophenyl)thio)-2-hydroxy-2-methylpropanamide, Bicalutamide impurity J, Bicalutamide EP Impurity J, BCT-S
| Molecular Formula | C18H14F4N2O2S |
|---|---|
| Molecular Weight | 398.07 g/mol |
| LogP | 4.19798 |
| Topological Polar Surface Area | 73.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 398.0712 |
| Heavy Atoms | 27 |
| Complexity | 874.4108 |
Chemical Identifiers
| CAS Number | 90356-78-8 |
|---|---|
| SMILES | CC(CSC1=CC=C(C=C1)F)(C(=O)NC2=CC(=C(C=C2)C#N)C(F)(F)F)O |
Product Overview
比卡鲁胺硫醚 (CAS 90356-78-8), with molecular formula C18H14F4N2O2S and molecular weight 398.07 g/mol. IUPAC: N-[4-cyano-3-(trifluoromethyl)phenyl]-3-(4-fluorophenyl)sulfanyl-2-hydroxy-2-methylpropanamide.
Chemical Property Profile of 比卡鲁胺硫醚
Property Insights of 比卡鲁胺硫醚
The XLogP value of 4.19798 indicates that 比卡鲁胺硫醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.12 Ų falls within the moderate polarity range, balancing permeability and solubility for 比卡鲁胺硫醚. Following Lipinski's Rule of Five, 比卡鲁胺硫醚 has 2 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 比卡鲁胺硫醚?
The CAS number of 比卡鲁胺硫醚 is 90356-78-8.
What is the molecular formula of 比卡鲁胺硫醚?
The molecular formula of 比卡鲁胺硫醚 is C18H14F4N2O2S.
What is the molecular weight of 比卡鲁胺硫醚?
The molecular weight of 比卡鲁胺硫醚 is 398.07 g/mol.
Where can I buy 比卡鲁胺硫醚?
You can request a quote for 比卡鲁胺硫醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 比卡鲁胺硫醚?
Yes, KEHONG BIO provides custom synthesis services for 比卡鲁胺硫醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.