1-(1,3-Dichloropropan-2-yl)phthalazine
TL;DR: 1-(1,3-Dichloropropan-2-yl)phthalazine (CAS 18076-30-7) is a chemical compound with molecular formula C11H10Cl2N2 and molecular weight 240.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-dichloropropan-2-yl)phthalazine
Also Known As: 1-(1,3-dichloropropan-2-yl)phthalazine, KST-1B1161, 1,3-Dichlor-2-(1-phthalazyl)-propan, Phthalazine, 1-[2-chloro-1-(chloromethyl)ethyl]-
| Molecular Formula | C11H10Cl2N2 |
|---|---|
| Molecular Weight | 240.02 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 25.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.02211 |
| Heavy Atoms | 15 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 18076-30-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=NN=C2C(CCl)CCl |
| InChIKey | OXULKMOOBKQMFO-UHFFFAOYSA-N |
Product Overview
1-(1,3-Dichloropropan-2-yl)phthalazine (CAS 18076-30-7), with molecular formula C11H10Cl2N2 and molecular weight 240.02 g/mol. IUPAC: 1-(1,3-dichloropropan-2-yl)phthalazine.
Chemical Property Profile of 1-(1,3-Dichloropropan-2-yl)phthalazine
Property Insights of 1-(1,3-Dichloropropan-2-yl)phthalazine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Dichloropropan-2-yl)phthalazine. With a topological polar surface area (TPSA) of 25.8 Ų, 1-(1,3-Dichloropropan-2-yl)phthalazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Dichloropropan-2-yl)phthalazine has 0 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 1-(1,3-Dichloropropan-2-yl)phthalazine?
The CAS number of 1-(1,3-Dichloropropan-2-yl)phthalazine is 18076-30-7.
What is the molecular formula of 1-(1,3-Dichloropropan-2-yl)phthalazine?
The molecular formula of 1-(1,3-Dichloropropan-2-yl)phthalazine is C11H10Cl2N2.
What is the molecular weight of 1-(1,3-Dichloropropan-2-yl)phthalazine?
The molecular weight of 1-(1,3-Dichloropropan-2-yl)phthalazine is 240.02 g/mol.
Where can I buy 1-(1,3-Dichloropropan-2-yl)phthalazine?
You can request a quote for 1-(1,3-Dichloropropan-2-yl)phthalazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Dichloropropan-2-yl)phthalazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Dichloropropan-2-yl)phthalazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.