5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one
TL;DR: 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one (CAS 313703-01-4) is a chemical compound with molecular formula C17H17NOS and molecular weight 283.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one
Also Known As: 5-phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one, 5-phenyl-3-[(thiophen-2-ylmethyl)amino]cyclohex-2-en-1-one
| Molecular Formula | C17H17NOS |
|---|---|
| Molecular Weight | 283.10 g/mol |
| LogP | 3.8683 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 283.1031 |
| Heavy Atoms | 20 |
| Complexity | 601.18494 |
Chemical Identifiers
| CAS Number | 313703-01-4 |
|---|---|
| SMILES | C1C(CC(=O)C=C1NCC2=CC=CS2)C3=CC=CC=C3 |
Product Overview
5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one (CAS 313703-01-4), with molecular formula C17H17NOS and molecular weight 283.10 g/mol. IUPAC: 5-phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one.
Chemical Property Profile of 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one
Property Insights of 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one
The XLogP value of 3.8683 indicates that 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one has 1 hydrogen bond donor(s) and 3 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 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one?
The CAS number of 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one is 313703-01-4.
What is the molecular formula of 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one?
The molecular formula of 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one is C17H17NOS.
What is the molecular weight of 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one?
The molecular weight of 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one is 283.10 g/mol.
Where can I buy 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one?
You can request a quote for 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Phenyl-3-(thiophen-2-ylmethylamino)cyclohex-2-en-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.