1(2H)-Phthalazinone, 4-chloro-2-methyl-
TL;DR: 1(2H)-Phthalazinone, 4-chloro-2-methyl- (CAS 40227-54-1) is a chemical compound with molecular formula C9H7ClN2O and molecular weight 194.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-methylphthalazin-1-one
Also Known As: 4-chloro-2-methylphthalazin-1-one, ChemDiv1_007271, 2-methyl-4-chlorophthalazone, 1(2H)-Phthalazinone, 4-chloro-2-methyl-, 4-Chloro-2-methylphthalazin-1(2H)-one
| Molecular Formula | C9H7ClN2O |
|---|---|
| Molecular Weight | 194.02 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.02469 |
| Heavy Atoms | 13 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 40227-54-1 |
|---|---|
| SMILES | CN1C(=O)C2=CC=CC=C2C(=N1)Cl |
| InChIKey | INENUUSXTXNSFV-UHFFFAOYSA-N |
Product Overview
1(2H)-Phthalazinone, 4-chloro-2-methyl- (CAS 40227-54-1), with molecular formula C9H7ClN2O and molecular weight 194.02 g/mol. IUPAC: 4-chloro-2-methylphthalazin-1-one.
Chemical Property Profile of 1(2H)-Phthalazinone, 4-chloro-2-methyl-
Property Insights of 1(2H)-Phthalazinone, 4-chloro-2-methyl-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(2H)-Phthalazinone, 4-chloro-2-methyl-. With a topological polar surface area (TPSA) of 32.7 Ų, 1(2H)-Phthalazinone, 4-chloro-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1(2H)-Phthalazinone, 4-chloro-2-methyl- 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(2H)-Phthalazinone, 4-chloro-2-methyl-?
The CAS number of 1(2H)-Phthalazinone, 4-chloro-2-methyl- is 40227-54-1.
What is the molecular formula of 1(2H)-Phthalazinone, 4-chloro-2-methyl-?
The molecular formula of 1(2H)-Phthalazinone, 4-chloro-2-methyl- is C9H7ClN2O.
What is the molecular weight of 1(2H)-Phthalazinone, 4-chloro-2-methyl-?
The molecular weight of 1(2H)-Phthalazinone, 4-chloro-2-methyl- is 194.02 g/mol.
Where can I buy 1(2H)-Phthalazinone, 4-chloro-2-methyl-?
You can request a quote for 1(2H)-Phthalazinone, 4-chloro-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(2H)-Phthalazinone, 4-chloro-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1(2H)-Phthalazinone, 4-chloro-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.