1-Butyl-1H-indazol-3-ol
TL;DR: 1-Butyl-1H-indazol-3-ol (CAS 4583-76-0) is a chemical compound with molecular formula C11H14N2O and molecular weight 190.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butyl-2H-indazol-3-one
Also Known As: 1-Butyl-1H-indazol-3-ol, 1-butyl-2H-indazol-3-one, 1H-Indazol-3-ol, 1-butyl-, NIOSH/NK8010500, 3H-Indazol-3-one, 1-butyl-1,2-dihydro-
| Molecular Formula | C11H14N2O |
|---|---|
| Molecular Weight | 190.11 g/mol |
| LogP | 2.1297 |
| Topological Polar Surface Area | 37.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.11061 |
| Heavy Atoms | 14 |
| Complexity | 481.23834 |
Chemical Identifiers
| CAS Number | 4583-76-0 |
|---|---|
| SMILES | CCCCN1C2=CC=CC=C2C(=O)N1 |
Product Overview
1-Butyl-1H-indazol-3-ol (CAS 4583-76-0), with molecular formula C11H14N2O and molecular weight 190.11 g/mol. IUPAC: 1-butyl-2H-indazol-3-one.
Chemical Property Profile of 1-Butyl-1H-indazol-3-ol
Property Insights of 1-Butyl-1H-indazol-3-ol
The XLogP value of 2.1297 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butyl-1H-indazol-3-ol. With a topological polar surface area (TPSA) of 37.79 Ų, 1-Butyl-1H-indazol-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butyl-1H-indazol-3-ol has 1 hydrogen bond donor(s) and 1 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 1-Butyl-1H-indazol-3-ol?
The CAS number of 1-Butyl-1H-indazol-3-ol is 4583-76-0.
What is the molecular formula of 1-Butyl-1H-indazol-3-ol?
The molecular formula of 1-Butyl-1H-indazol-3-ol is C11H14N2O.
What is the molecular weight of 1-Butyl-1H-indazol-3-ol?
The molecular weight of 1-Butyl-1H-indazol-3-ol is 190.11 g/mol.
Where can I buy 1-Butyl-1H-indazol-3-ol?
You can request a quote for 1-Butyl-1H-indazol-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butyl-1H-indazol-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-Butyl-1H-indazol-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.