![3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide structure](/static/products/6944/694463-91-7.webp)
3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide
TL;DR: 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide (CAS 694463-91-7) is a chemical compound with molecular formula C18H16ClN3O2 and molecular weight 341.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide
Also Known As: VU0047980-1, 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide, 3-(4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl)-N-methylpropanamide, 3-[4-(4-chlorophenyl)-1-oxophthalazin-2(1H)-yl]-N-methylpropanamide, 3-[4-(4-chlorophenyl)-1-oxo-2(1H)-phthalazinyl]-N-methylpropanamide
| Molecular Formula | C18H16ClN3O2 |
|---|---|
| Molecular Weight | 341.09 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.0931 |
| Heavy Atoms | 24 |
| Complexity | 514.0 |
Chemical Identifiers
| CAS Number | 694463-91-7 |
|---|---|
| SMILES | CNC(=O)CCN1C(=O)C2=CC=CC=C2C(=N1)C3=CC=C(C=C3)Cl |
| InChIKey | VYHZCUDYCFGULE-UHFFFAOYSA-N |
Product Overview
3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide (CAS 694463-91-7), with molecular formula C18H16ClN3O2 and molecular weight 341.09 g/mol. IUPAC: 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide.
Chemical Property Profile of 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide
Property Insights of 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide. Following Lipinski's Rule of Five, 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide 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 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide?
The CAS number of 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide is 694463-91-7.
What is the molecular formula of 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide?
The molecular formula of 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide is C18H16ClN3O2.
What is the molecular weight of 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide?
The molecular weight of 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide is 341.09 g/mol.
Where can I buy 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide?
You can request a quote for 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(4-chlorophenyl)-1-oxophthalazin-2-yl]-N-methylpropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.