RefChem:211609
TL;DR: RefChem:211609 (CAS 13835-15-9) is a chemical compound with molecular formula C19H20ClN3O and molecular weight 341.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-chlorophenyl)methyl]-2-[2-(dimethylamino)ethyl]phthalazin-1-one
Also Known As: 1(2H)-Phthalazinone, 4-(p-chlorobenzyl)-2-(2-(dimethylamino)ethyl)-, hydrochloride, 4-(p-Chlorobenzyl)-2-(2-(dimethylamino)ethyl)-1(2H)-phthalazinone hydrochloride, 1(2H)-Phthalazinone, 4-((4-chlorophenyl)methyl)-2-(2-(dimethylamino)ethyl)-, 4-[(4-chlorophenyl)methyl]-2-[2-(dimethylamino)ethyl]phthala, 1(2H)-Phthalazinone, 4-(p-chlorobenzyl)-2-[2-(dimethylamino)ethyl]-
| Molecular Formula | C19H20ClN3O |
|---|---|
| Molecular Weight | 341.13 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 35.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.1295 |
| Heavy Atoms | 24 |
| Complexity | 471.0 |
Chemical Identifiers
| CAS Number | 13835-15-9 |
|---|---|
| SMILES | CN(C)CCN1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=C(C=C3)Cl |
| InChIKey | WRGOSJVRKURGMQ-UHFFFAOYSA-N |
Product Overview
RefChem:211609 (CAS 13835-15-9), with molecular formula C19H20ClN3O and molecular weight 341.13 g/mol. IUPAC: 4-[(4-chlorophenyl)methyl]-2-[2-(dimethylamino)ethyl]phthalazin-1-one.
Chemical Property Profile of RefChem:211609
Property Insights of RefChem:211609
The XLogP value of 3.5 indicates that RefChem:211609 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.9 Ų, RefChem:211609 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:211609 has 0 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 RefChem:211609?
The CAS number of RefChem:211609 is 13835-15-9.
What is the molecular formula of RefChem:211609?
The molecular formula of RefChem:211609 is C19H20ClN3O.
What is the molecular weight of RefChem:211609?
The molecular weight of RefChem:211609 is 341.13 g/mol.
Where can I buy RefChem:211609?
You can request a quote for RefChem:211609 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:211609?
Yes, KEHONG BIO provides custom synthesis services for RefChem:211609 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.