2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone
TL;DR: 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone (CAS 113722-81-9) is a chemical compound with molecular formula C16H14ClNO2 and molecular weight 287.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-6-(3-hydroxypropylamino)phenalen-1-one
Also Known As: PHENALEMINE 625, 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone, 2-chloro-6-(3-hydroxypropylamino)phenalen-1-one, 2-Chloro-6-((3-hydroxypropyl)amino)-1H-phenalen-1-one, 2-chloro-6-[(3-hydroxypropyl)amino]-1H-phenalen-1-one
| Molecular Formula | C16H14ClNO2 |
|---|---|
| Molecular Weight | 287.07 g/mol |
| LogP | 3.4101 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 287.07132 |
| Heavy Atoms | 20 |
| Complexity | 721.7338 |
Chemical Identifiers
| CAS Number | 113722-81-9 |
|---|---|
| SMILES | C1=CC2=C(C=CC3=C2C(=C1)C(=O)C(=C3)Cl)NCCCO |
Product Overview
2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone (CAS 113722-81-9), with molecular formula C16H14ClNO2 and molecular weight 287.07 g/mol. IUPAC: 2-chloro-6-(3-hydroxypropylamino)phenalen-1-one.
Chemical Property Profile of 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone
Property Insights of 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone
The XLogP value of 3.4101 indicates that 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone has 2 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 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone?
The CAS number of 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone is 113722-81-9.
What is the molecular formula of 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone?
The molecular formula of 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone is C16H14ClNO2.
What is the molecular weight of 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone?
The molecular weight of 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone is 287.07 g/mol.
Where can I buy 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone?
You can request a quote for 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-6-(3-hydroxypropylamino)-1-phenalenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.