RefChem:315884
TL;DR: RefChem:315884 (CAS 62707-48-6) is a chemical compound with molecular formula C14H15N3O4 and molecular weight 289.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoacetate
Also Known As: Acetic acid, ((2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)oxo-, methyl ester, ((2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino)oxoacetic acid methyl ester, methyl (1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)carbamoylformate, methyl 2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoacetate, Methyl [(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino](oxo)acetate
| Molecular Formula | C14H15N3O4 |
|---|---|
| Molecular Weight | 289.11 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 79.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.10626 |
| Heavy Atoms | 21 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 62707-48-6 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(=O)OC |
| InChIKey | QIXNGEWWZDHCDF-UHFFFAOYSA-N |
Product Overview
RefChem:315884 (CAS 62707-48-6), with molecular formula C14H15N3O4 and molecular weight 289.11 g/mol. IUPAC: methyl 2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoacetate.
Chemical Property Profile of RefChem:315884
Property Insights of RefChem:315884
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:315884. The TPSA of 79.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:315884. Following Lipinski's Rule of Five, RefChem:315884 has 1 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 RefChem:315884?
The CAS number of RefChem:315884 is 62707-48-6.
What is the molecular formula of RefChem:315884?
The molecular formula of RefChem:315884 is C14H15N3O4.
What is the molecular weight of RefChem:315884?
The molecular weight of RefChem:315884 is 289.11 g/mol.
Where can I buy RefChem:315884?
You can request a quote for RefChem:315884 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:315884?
Yes, KEHONG BIO provides custom synthesis services for RefChem:315884 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.