5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one
TL;DR: 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one (CAS 98366-74-6) is a chemical compound with molecular formula C14H16ClN3O and molecular weight 277.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(butylamino)-4-chloro-2-phenylpyridazin-3-one
Also Known As: 5-(butylamino)-4-chloro-2-phenylpyridazin-3-one, BAS 00667539, 5-(butylamino)-4-chloro-2-phenyl-3(2H)-pyridazinone, AE-641/00401059, 5-Butylamino-4-chloro-2-phenyl-2H-pyridazin-3-one
| Molecular Formula | C14H16ClN3O |
|---|---|
| Molecular Weight | 277.10 g/mol |
| LogP | 3.0979 |
| Topological Polar Surface Area | 46.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 277.09818 |
| Heavy Atoms | 19 |
| Complexity | 595.38525 |
Chemical Identifiers
| CAS Number | 98366-74-6 |
|---|---|
| SMILES | CCCCNC1=C(C(=O)N(N=C1)C2=CC=CC=C2)Cl |
Product Overview
5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one (CAS 98366-74-6), with molecular formula C14H16ClN3O and molecular weight 277.10 g/mol. IUPAC: 5-(butylamino)-4-chloro-2-phenylpyridazin-3-one.
Chemical Property Profile of 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one
Property Insights of 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one
The XLogP value of 3.0979 indicates that 5-(Butylamino)-4-chloro-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 46.92 Ų, 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Butylamino)-4-chloro-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 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one?
The CAS number of 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one is 98366-74-6.
What is the molecular formula of 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one?
The molecular formula of 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one is C14H16ClN3O.
What is the molecular weight of 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one?
The molecular weight of 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one is 277.10 g/mol.
Where can I buy 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one?
You can request a quote for 5-(Butylamino)-4-chloro-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 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(Butylamino)-4-chloro-2-phenylpyridazin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.