2-氨基-4'-异丙基二苯基硫醚
TL;DR: 2-氨基-4'-异丙基二苯基硫醚 (CAS 5472-42-4) is a chemical compound with molecular formula C15H17NS and molecular weight 243.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氨基-4'-异丙基二苯基硫醚
2-(4-propan-2-ylphenyl)sulfanylaniline
Also Known As: 2-Amino-4'-isopropyldiphenyl sulfide, 2-(4-propan-2-ylphenyl)sulfanylaniline, Benzenamine, 2-((4-(1-methylethyl)phenyl)thio)-, 2-{[4-(propan-2-yl)phenyl]sulfanyl}aniline, Benzenamine,2-((4-(1-methylethyl)phenyl)thio)
| Molecular Formula | C15H17NS |
|---|---|
| Molecular Weight | 243.11 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 51.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.10817 |
| Heavy Atoms | 17 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 5472-42-4 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)SC2=CC=CC=C2N |
| InChIKey | NKTPLFDQCKOYHT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氨基-4'-异丙基二苯基硫醚 (CAS 5472-42-4), with molecular formula C15H17NS and molecular weight 243.11 g/mol. IUPAC: 2-(4-propan-2-ylphenyl)sulfanylaniline.
Chemical Property Profile of 2-氨基-4'-异丙基二苯基硫醚
Property Insights of 2-氨基-4'-异丙基二苯基硫醚
The XLogP value of 4.4 indicates that 2-氨基-4'-异丙基二苯基硫醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.3 Ų, 2-氨基-4'-异丙基二苯基硫醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氨基-4'-异丙基二苯基硫醚 has 1 hydrogen bond donor(s) and 2 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 2-氨基-4'-异丙基二苯基硫醚?
The CAS number of 2-氨基-4'-异丙基二苯基硫醚 is 5472-42-4.
What is the molecular formula of 2-氨基-4'-异丙基二苯基硫醚?
The molecular formula of 2-氨基-4'-异丙基二苯基硫醚 is C15H17NS.
What is the molecular weight of 2-氨基-4'-异丙基二苯基硫醚?
The molecular weight of 2-氨基-4'-异丙基二苯基硫醚 is 243.11 g/mol.
Where can I buy 2-氨基-4'-异丙基二苯基硫醚?
You can request a quote for 2-氨基-4'-异丙基二苯基硫醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氨基-4'-异丙基二苯基硫醚?
Yes, KEHONG BIO provides custom synthesis services for 2-氨基-4'-异丙基二苯基硫醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.