1H-Indazole, 1-benzoyl-6-nitro-
TL;DR: 1H-Indazole, 1-benzoyl-6-nitro- (CAS 36174-00-2) is a chemical compound with molecular formula C14H9N3O3 and molecular weight 267.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-nitroindazol-1-yl)-phenylmethanone
Also Known As: 1-benzoyl-6-nitro-1H-indazole, 1H-Indazole, 1-benzoyl-6-nitro-, (6-Nitro-1H-indazol-1-yl)(phenyl)methanone, (6-nitroindazol-1-yl)-phenylmethanone, 6-nitro(1H-indazolyl) phenyl ketone
| Molecular Formula | C14H9N3O3 |
|---|---|
| Molecular Weight | 267.06 g/mol |
| LogP | 2.633 |
| Topological Polar Surface Area | 78.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.0644 |
| Heavy Atoms | 20 |
| Complexity | 808.90204 |
Chemical Identifiers
| CAS Number | 36174-00-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)N2C3=C(C=CC(=C3)[N+](=O)[O-])C=N2 |
Product Overview
1H-Indazole, 1-benzoyl-6-nitro- (CAS 36174-00-2), with molecular formula C14H9N3O3 and molecular weight 267.06 g/mol. IUPAC: (6-nitroindazol-1-yl)-phenylmethanone.
Chemical Property Profile of 1H-Indazole, 1-benzoyl-6-nitro-
Property Insights of 1H-Indazole, 1-benzoyl-6-nitro-
The XLogP value of 2.633 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indazole, 1-benzoyl-6-nitro-. The TPSA of 78.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Indazole, 1-benzoyl-6-nitro-. Following Lipinski's Rule of Five, 1H-Indazole, 1-benzoyl-6-nitro- has 0 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 1H-Indazole, 1-benzoyl-6-nitro-?
The CAS number of 1H-Indazole, 1-benzoyl-6-nitro- is 36174-00-2.
What is the molecular formula of 1H-Indazole, 1-benzoyl-6-nitro-?
The molecular formula of 1H-Indazole, 1-benzoyl-6-nitro- is C14H9N3O3.
What is the molecular weight of 1H-Indazole, 1-benzoyl-6-nitro-?
The molecular weight of 1H-Indazole, 1-benzoyl-6-nitro- is 267.06 g/mol.
Where can I buy 1H-Indazole, 1-benzoyl-6-nitro-?
You can request a quote for 1H-Indazole, 1-benzoyl-6-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indazole, 1-benzoyl-6-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indazole, 1-benzoyl-6-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.