乙酸铒
TL;DR: 乙酸铒 (CAS 25519-10-2) is a chemical compound with molecular formula C24H27N5O4 and molecular weight 449.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙酸铒
N'-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]phenyl]-N-(2-methylpropyl)oxamide
Also Known As: Ethanediamide, N-(2-(((2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)carbonyl)phenyl)-N'-(2-methylpropyl)-, n-{2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1h-pyrazol-4-yl)carbamoyl]phenyl}-n'-(2-methylpropyl)ethanediamide, N'-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]phenyl]-N-(2-methylpropyl)oxamide, N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-{2-[(2-methylpropyl)amino](oxo)acetamido}benzene-1-carboximidic acid, N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-{2-[(2-methylpropyl)amino]-2-oxoacetamido}benzene-1-carboximidic acid
| Molecular Formula | C24H27N5O4 |
|---|---|
| Molecular Weight | 449.21 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 449.2063 |
| Heavy Atoms | 33 |
| Complexity | 803.0 |
Chemical Identifiers
| CAS Number | 25519-10-2 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC=CC=C3NC(=O)C(=O)NCC(C)C |
| InChIKey | UVDHAUJSOQXZHW-UHFFFAOYSA-N |
Product Overview
乙酸铒 (CAS 25519-10-2), with molecular formula C24H27N5O4 and molecular weight 449.21 g/mol. IUPAC: N'-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]phenyl]-N-(2-methylpropyl)oxamide.
Chemical Property Profile of 乙酸铒
Property Insights of 乙酸铒
The XLogP value of 3.8 indicates that 乙酸铒 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 乙酸铒. Following Lipinski's Rule of Five, 乙酸铒 has 3 hydrogen bond donor(s) and 5 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 乙酸铒?
The CAS number of 乙酸铒 is 25519-10-2.
What is the molecular formula of 乙酸铒?
The molecular formula of 乙酸铒 is C24H27N5O4.
What is the molecular weight of 乙酸铒?
The molecular weight of 乙酸铒 is 449.21 g/mol.
Where can I buy 乙酸铒?
You can request a quote for 乙酸铒 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙酸铒?
Yes, KEHONG BIO provides custom synthesis services for 乙酸铒 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.