![[(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate structure](/static/products/100/1002000-62-5.png)
[(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate
TL;DR: [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate (CAS 1002000-62-5) is a chemical compound with molecular formula C18H18N4O4 and molecular weight 354.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-(4-oxo-3H-phthalazin-1-yl)acetate
Also Known As: [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate|[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-(4-oxo-3H-phthalazin-1-yl)acetate|EN300-26688758
| Molecular Formula | C18H18N4O4 |
|---|---|
| Molecular Weight | 354.13 g/mol |
| LogP | 0.96138 |
| Topological Polar Surface Area | 124.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 354.1328 |
| Heavy Atoms | 26 |
| Complexity | 938.09204 |
Chemical Identifiers
| CAS Number | 1002000-62-5 |
|---|---|
| SMILES | C1CCC(C1)(C#N)NC(=O)COC(=O)CC2=NNC(=O)C3=CC=CC=C32 |
Product Overview
[(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate (CAS 1002000-62-5), with molecular formula C18H18N4O4 and molecular weight 354.13 g/mol. IUPAC: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 2-(4-oxo-3H-phthalazin-1-yl)acetate.
Chemical Property Profile of [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate
Property Insights of [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate
The XLogP value of 0.96138 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate. The TPSA of 124.94 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate. Following Lipinski's Rule of Five, [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate has 2 hydrogen bond donor(s) and 6 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-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate?
The CAS number of [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate is 1002000-62-5.
What is the molecular formula of [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate?
The molecular formula of [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate is C18H18N4O4.
What is the molecular weight of [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate?
The molecular weight of [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate is 354.13 g/mol.
Where can I buy [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate?
You can request a quote for [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for [(1-cyanocyclopentyl)carbamoyl]methyl 2-(4-oxo-3,4-dihydrophthalazin-1-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.