5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one
TL;DR: 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one (CAS 5509-81-9) is a chemical compound with molecular formula C15H17N3O2S and molecular weight 303.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one
Also Known As: 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one, 2-chloro-4-nitro-N-1H-1,2,4-triazol-5-ylbenzamide, 4-(Benzylsulfanyl)-5-(morpholin-4-yl)pyridazin-3-ol
| Molecular Formula | C15H17N3O2S |
|---|---|
| Molecular Weight | 303.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 303.10416 |
| Heavy Atoms | 21 |
| Complexity | 438.0 |
Chemical Identifiers
| CAS Number | 5509-81-9 |
|---|---|
| SMILES | C1COCCN1C2=C(C(=O)NN=C2)SCC3=CC=CC=C3 |
| InChIKey | NSMXYMJPLOYLFZ-UHFFFAOYSA-N |
Product Overview
5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one (CAS 5509-81-9), with molecular formula C15H17N3O2S and molecular weight 303.10 g/mol. IUPAC: 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one.
Chemical Property Profile of 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one
Property Insights of 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one. Following Lipinski's Rule of Five, 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one has 1 hydrogen bond donor(s) and 5 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-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one?
The CAS number of 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one is 5509-81-9.
What is the molecular formula of 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one?
The molecular formula of 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one is C15H17N3O2S.
What is the molecular weight of 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one?
The molecular weight of 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one is 303.10 g/mol.
Where can I buy 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one?
You can request a quote for 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one?
Yes, KEHONG BIO provides custom synthesis services for 5-benzylsulfanyl-4-morpholin-4-yl-1H-pyridazin-6-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.