1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea
TL;DR: 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea (CAS 899985-32-1) is a chemical compound with molecular formula C13H16N4O2 and molecular weight 260.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-oxo-3H-phthalazin-1-yl)methyl]-3-propylurea
Also Known As: 1-((4-oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea, 1-[(4-oxo-3H-phthalazin-1-yl)methyl]-3-propylurea, 1-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]-3-propylurea, F2758-0185
| Molecular Formula | C13H16N4O2 |
|---|---|
| Molecular Weight | 260.13 g/mol |
| LogP | 1.1323 |
| Topological Polar Surface Area | 86.88 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.12732 |
| Heavy Atoms | 19 |
| Complexity | 635.821 |
Chemical Identifiers
| CAS Number | 899985-32-1 |
|---|---|
| SMILES | CCCNC(=O)NCC1=NNC(=O)C2=CC=CC=C21 |
Product Overview
1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea (CAS 899985-32-1), with molecular formula C13H16N4O2 and molecular weight 260.13 g/mol. IUPAC: 1-[(4-oxo-3H-phthalazin-1-yl)methyl]-3-propylurea.
Chemical Property Profile of 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea
Property Insights of 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea
The XLogP value of 1.1323 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea. The TPSA of 86.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea. Following Lipinski's Rule of Five, 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea has 3 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 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea?
The CAS number of 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea is 899985-32-1.
What is the molecular formula of 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea?
The molecular formula of 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea is C13H16N4O2.
What is the molecular weight of 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea?
The molecular weight of 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea is 260.13 g/mol.
Where can I buy 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea?
You can request a quote for 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-((4-Oxo-3,4-dihydrophthalazin-1-yl)methyl)-3-propylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.