4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one
TL;DR: 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one (CAS 98796-13-5) is a chemical compound with molecular formula C16H18ClN3O and molecular weight 303.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one
Also Known As: 4-chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one, AB00082665-01, 4-chloro-5-(cyclohexylamino)-2-phenyl-2,3-dihydropyridazin-3-one, 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3(2H)-one
| Molecular Formula | C16H18ClN3O |
|---|---|
| Molecular Weight | 303.11 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 44.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 303.11383 |
| Heavy Atoms | 21 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 98796-13-5 |
|---|---|
| SMILES | C1CCC(CC1)NC2=C(C(=O)N(N=C2)C3=CC=CC=C3)Cl |
| InChIKey | DHKVYRJWSACVAP-UHFFFAOYSA-N |
Product Overview
4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one (CAS 98796-13-5), with molecular formula C16H18ClN3O and molecular weight 303.11 g/mol. IUPAC: 4-chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one.
Chemical Property Profile of 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one
Property Insights of 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one
The XLogP value of 3.2 indicates that 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.7 Ų, 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one has 1 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 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one?
The CAS number of 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one is 98796-13-5.
What is the molecular formula of 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one?
The molecular formula of 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one is C16H18ClN3O.
What is the molecular weight of 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one?
The molecular weight of 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one is 303.11 g/mol.
Where can I buy 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one?
You can request a quote for 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-5-(cyclohexylamino)-2-phenylpyridazin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.