starbld0006294
TL;DR: starbld0006294 (CAS 1004428-11-8) is a chemical compound with molecular formula C21H24N4O4 and molecular weight 396.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 3-ethyl-4-oxophthalazine-1-carboxylate
Also Known As: starbld0006294, [(1-cyanocyclohexyl)(methyl)carbamoyl]methyl 3-ethyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate, 2-((1-Cyanocyclohexyl)(methyl)amino)-2-oxoethyl 3-ethyl-4-oxo-3,4-dihydrophthalazine-1-carboxylate, [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 3-ethyl-4-oxophthalazine-1-carboxylate
| Molecular Formula | C21H24N4O4 |
|---|---|
| Molecular Weight | 396.18 g/mol |
| LogP | 2.25808 |
| Topological Polar Surface Area | 105.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.17975 |
| Heavy Atoms | 29 |
| Complexity | 1031.1333 |
Chemical Identifiers
| CAS Number | 1004428-11-8 |
|---|---|
| SMILES | CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC(=O)N(C)C3(CCCCC3)C#N |
Product Overview
starbld0006294 (CAS 1004428-11-8), with molecular formula C21H24N4O4 and molecular weight 396.18 g/mol. IUPAC: [2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl] 3-ethyl-4-oxophthalazine-1-carboxylate.
Chemical Property Profile of starbld0006294
Property Insights of starbld0006294
The XLogP value of 2.25808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for starbld0006294. The TPSA of 105.29 Ų falls within the moderate polarity range, balancing permeability and solubility for starbld0006294. Following Lipinski's Rule of Five, starbld0006294 has 0 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 starbld0006294?
The CAS number of starbld0006294 is 1004428-11-8.
What is the molecular formula of starbld0006294?
The molecular formula of starbld0006294 is C21H24N4O4.
What is the molecular weight of starbld0006294?
The molecular weight of starbld0006294 is 396.18 g/mol.
Where can I buy starbld0006294?
You can request a quote for starbld0006294 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for starbld0006294?
Yes, KEHONG BIO provides custom synthesis services for starbld0006294 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.