4-((Dimethylamino)methyl)-1(2H)-phthalazinone
TL;DR: 4-((Dimethylamino)methyl)-1(2H)-phthalazinone (CAS 71064-85-2) is a chemical compound with molecular formula C11H13N3O and molecular weight 203.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(dimethylamino)methyl]-2H-phthalazin-1-one
Also Known As: 4-[(dimethylamino)methyl]-2H-phthalazin-1-one, 4-((Dimethylamino)methyl)-1(2H)-phthalazinone, 4-[(dimethylamino)methyl]-1(2H)-phthalazinone, 4-(dimethylaminomethyl)-2H-phthalazin-1-one, 1(2H)-Phthalazinone, 4-[(dimethylamino)methyl]-
| Molecular Formula | C11H13N3O |
|---|---|
| Molecular Weight | 203.11 g/mol |
| LogP | 0.9847 |
| Topological Polar Surface Area | 48.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.10587 |
| Heavy Atoms | 15 |
| Complexity | 530.58923 |
Chemical Identifiers
| CAS Number | 71064-85-2 |
|---|---|
| SMILES | CN(C)CC1=NNC(=O)C2=CC=CC=C21 |
Product Overview
4-((Dimethylamino)methyl)-1(2H)-phthalazinone (CAS 71064-85-2), with molecular formula C11H13N3O and molecular weight 203.11 g/mol. IUPAC: 4-[(dimethylamino)methyl]-2H-phthalazin-1-one.
Chemical Property Profile of 4-((Dimethylamino)methyl)-1(2H)-phthalazinone
Property Insights of 4-((Dimethylamino)methyl)-1(2H)-phthalazinone
The XLogP value of 0.9847 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((Dimethylamino)methyl)-1(2H)-phthalazinone. With a topological polar surface area (TPSA) of 48.99 Ų, 4-((Dimethylamino)methyl)-1(2H)-phthalazinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((Dimethylamino)methyl)-1(2H)-phthalazinone 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 4-((Dimethylamino)methyl)-1(2H)-phthalazinone?
The CAS number of 4-((Dimethylamino)methyl)-1(2H)-phthalazinone is 71064-85-2.
What is the molecular formula of 4-((Dimethylamino)methyl)-1(2H)-phthalazinone?
The molecular formula of 4-((Dimethylamino)methyl)-1(2H)-phthalazinone is C11H13N3O.
What is the molecular weight of 4-((Dimethylamino)methyl)-1(2H)-phthalazinone?
The molecular weight of 4-((Dimethylamino)methyl)-1(2H)-phthalazinone is 203.11 g/mol.
Where can I buy 4-((Dimethylamino)methyl)-1(2H)-phthalazinone?
You can request a quote for 4-((Dimethylamino)methyl)-1(2H)-phthalazinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((Dimethylamino)methyl)-1(2H)-phthalazinone?
Yes, KEHONG BIO provides custom synthesis services for 4-((Dimethylamino)methyl)-1(2H)-phthalazinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.