3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide
TL;DR: 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide (CAS 899952-09-1) is a chemical compound with molecular formula C14H16ClN3O2 and molecular weight 293.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-2,2-dimethyl-N-[(4-oxo-3H-phthalazin-1-yl)methyl]propanamide
Also Known As: VU0496593-1, F2758-0030, 3-chloro-2,2-dimethyl-N-[(4-oxo-3H-phthalazin-1-yl)methyl]propanamide, 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide, N-[(4-oxo-3,4-dihydro-1-phthalazinyl)methyl]3-chloro-2,2-dimethylpropionamide
| Molecular Formula | C14H16ClN3O2 |
|---|---|
| Molecular Weight | 293.09 g/mol |
| LogP | 1.8043 |
| Topological Polar Surface Area | 74.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.0931 |
| Heavy Atoms | 20 |
| Complexity | 694.12366 |
Chemical Identifiers
| CAS Number | 899952-09-1 |
|---|---|
| SMILES | CC(C)(CCl)C(=O)NCC1=NNC(=O)C2=CC=CC=C21 |
Product Overview
3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide (CAS 899952-09-1), with molecular formula C14H16ClN3O2 and molecular weight 293.09 g/mol. IUPAC: 3-chloro-2,2-dimethyl-N-[(4-oxo-3H-phthalazin-1-yl)methyl]propanamide.
Chemical Property Profile of 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide
Property Insights of 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide
The XLogP value of 1.8043 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide. The TPSA of 74.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide. Following Lipinski's Rule of Five, 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide 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 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide?
The CAS number of 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide is 899952-09-1.
What is the molecular formula of 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide?
The molecular formula of 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide is C14H16ClN3O2.
What is the molecular weight of 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide?
The molecular weight of 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide is 293.09 g/mol.
Where can I buy 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide?
You can request a quote for 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-2,2-dimethyl-N-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.