氨基比林
TL;DR: 氨基比林 (CAS 58-15-1) is a chemical compound with molecular formula C13H17N3O and molecular weight 231.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氨基比林
4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one
Also Known As: aminophenazone, AMINOPYRINE, Amidopyrine, Dipyrine, Amidopyrazoline
| Molecular Formula | C13H17N3O |
|---|---|
| Molecular Weight | 231.14 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 26.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.13716 |
| Heavy Atoms | 17 |
| Complexity | 343.0 |
| Melting Point | 225 to 108.9 °C |
| Solubility | greater than or equal to 100 mg/mL at 72 °F (NTP, 1992) |
| Refractive Index | ALPHA 1.520, GAMMA 1.732 |
Chemical Identifiers
| CAS Number | 58-15-1 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N(C)C |
| InChIKey | RMMXTBMQSGEXHJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氨基比林 (CAS 58-15-1), with molecular formula C13H17N3O and molecular weight 231.14 g/mol. IUPAC: 4-(dimethylamino)-1,5-dimethyl-2-phenylpyrazol-3-one.
Chemical Property Profile of 氨基比林
Property Insights of 氨基比林
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氨基比林. With a topological polar surface area (TPSA) of 26.8 Ų, 氨基比林 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氨基比林 has 0 hydrogen bond donor(s) and 3 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 氨基比林?
The CAS number of 氨基比林 is 58-15-1.
What is the molecular formula of 氨基比林?
The molecular formula of 氨基比林 is C13H17N3O.
What is the molecular weight of 氨基比林?
The molecular weight of 氨基比林 is 231.14 g/mol.
Where can I buy 氨基比林?
You can request a quote for 氨基比林 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氨基比林?
Yes, KEHONG BIO provides custom synthesis services for 氨基比林 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.