Methyl 4-(3-amino-5-methylpyrazolyl)butanoate
TL;DR: Methyl 4-(3-amino-5-methylpyrazolyl)butanoate (CAS 956437-83-5) is a chemical compound with molecular formula C9H15N3O2 and molecular weight 197.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(3-amino-5-methylpyrazol-1-yl)butanoate
Also Known As: ZERO/004520, methyl 4-(3-amino-5-methylpyrazolyl)butanoate, methyl 4-(3-amino-5-methyl-1H-pyrazol-1-yl)butanoate, methyl 4-(3-amino-5-methylpyrazol-1-yl)butanoate, methyl 4-(3-amino-5-methyl-1{H}-pyrazol-1-yl)butanoate
| Molecular Formula | C9H15N3O2 |
|---|---|
| Molecular Weight | 197.12 g/mol |
| LogP | 0.72692 |
| Topological Polar Surface Area | 70.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 197.11642 |
| Heavy Atoms | 14 |
| Complexity | 319.85703 |
Chemical Identifiers
| CAS Number | 956437-83-5 |
|---|---|
| SMILES | CC1=CC(=NN1CCCC(=O)OC)N |
Product Overview
Methyl 4-(3-amino-5-methylpyrazolyl)butanoate (CAS 956437-83-5), with molecular formula C9H15N3O2 and molecular weight 197.12 g/mol. IUPAC: methyl 4-(3-amino-5-methylpyrazol-1-yl)butanoate.
Chemical Property Profile of Methyl 4-(3-amino-5-methylpyrazolyl)butanoate
Property Insights of Methyl 4-(3-amino-5-methylpyrazolyl)butanoate
The XLogP value of 0.72692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(3-amino-5-methylpyrazolyl)butanoate. The TPSA of 70.14 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(3-amino-5-methylpyrazolyl)butanoate. Following Lipinski's Rule of Five, Methyl 4-(3-amino-5-methylpyrazolyl)butanoate has 1 hydrogen bond donor(s) and 4 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 Methyl 4-(3-amino-5-methylpyrazolyl)butanoate?
The CAS number of Methyl 4-(3-amino-5-methylpyrazolyl)butanoate is 956437-83-5.
What is the molecular formula of Methyl 4-(3-amino-5-methylpyrazolyl)butanoate?
The molecular formula of Methyl 4-(3-amino-5-methylpyrazolyl)butanoate is C9H15N3O2.
What is the molecular weight of Methyl 4-(3-amino-5-methylpyrazolyl)butanoate?
The molecular weight of Methyl 4-(3-amino-5-methylpyrazolyl)butanoate is 197.12 g/mol.
Where can I buy Methyl 4-(3-amino-5-methylpyrazolyl)butanoate?
You can request a quote for Methyl 4-(3-amino-5-methylpyrazolyl)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-(3-amino-5-methylpyrazolyl)butanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(3-amino-5-methylpyrazolyl)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.