phenylselenoamide
TL;DR: phenylselenoamide (CAS 5977-82-2) is a chemical compound with molecular formula C22H23FN4OS and molecular weight 410.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-[(4-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]cyclobutanecarboxamide
Also Known As: phenylselenoamide, N-[[5-[(4-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]cyclobutanecarboxamide, N-{[5-{[(4-Fluorophenyl)methyl]sulfanyl}-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl}cyclobutanecarboxamide
| Molecular Formula | C22H23FN4OS |
|---|---|
| Molecular Weight | 410.16 g/mol |
| LogP | 4.42342 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.15765 |
| Heavy Atoms | 29 |
| Complexity | 981.0518 |
Chemical Identifiers
| CAS Number | 5977-82-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)F)CNC(=O)C4CCC4 |
Product Overview
phenylselenoamide (CAS 5977-82-2), with molecular formula C22H23FN4OS and molecular weight 410.16 g/mol. IUPAC: N-[[5-[(4-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]methyl]cyclobutanecarboxamide.
Chemical Property Profile of phenylselenoamide
Property Insights of phenylselenoamide
The XLogP value of 4.42342 indicates that phenylselenoamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, phenylselenoamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, phenylselenoamide has 1 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 phenylselenoamide?
The CAS number of phenylselenoamide is 5977-82-2.
What is the molecular formula of phenylselenoamide?
The molecular formula of phenylselenoamide is C22H23FN4OS.
What is the molecular weight of phenylselenoamide?
The molecular weight of phenylselenoamide is 410.16 g/mol.
Where can I buy phenylselenoamide?
You can request a quote for phenylselenoamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for phenylselenoamide?
Yes, KEHONG BIO provides custom synthesis services for phenylselenoamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.