RefChem:403503
TL;DR: RefChem:403503 (CAS 109576-79-6) is a chemical compound with molecular formula C17H13ClN3Se and molecular weight 374.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: N-(4-chlorophenyl)-1-(5-, 4-(((4-Chlorophenyl)amino)methylene)-3-methyl-1-phenyl-1H-pyrazole-5(4H)-selenone, 4-((4-CL-PHENYLAMINO)-METHYLENE)-5-METHYL-2-PHENYL-2,4-DIHYDRO-PYRAZOLE-3-SELONE, (4Z)-4-(((4-chlorophenyl)amino)methylidene)-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazole-5-selone, (4Z)-4-{[(4-chlorophenyl)amino]methylidene}-3-methyl-1-phenyl-4,5-dihydro-1H-pyrazole-5-selone
| Molecular Formula | C17H13ClN3Se |
|---|---|
| Molecular Weight | 374.00 g/mol |
| LogP | 3.37852 |
| Topological Polar Surface Area | 30.18 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 373.9963 |
| Heavy Atoms | 22 |
| Complexity | 807.92535 |
Chemical Identifiers
| CAS Number | 109576-79-6 |
|---|---|
| SMILES | CC1=NN(C(=C1C=NC2=CC=C(C=C2)Cl)[Se])C3=CC=CC=C3 |
Product Overview
RefChem:403503 (CAS 109576-79-6), with molecular formula C17H13ClN3Se and molecular weight 374.00 g/mol.
Chemical Property Profile of RefChem:403503
Property Insights of RefChem:403503
The XLogP value of 3.37852 indicates that RefChem:403503 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.18 Ų, RefChem:403503 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:403503 has 0 hydrogen bond donor(s) and 2 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 RefChem:403503?
The CAS number of RefChem:403503 is 109576-79-6.
What is the molecular formula of RefChem:403503?
The molecular formula of RefChem:403503 is C17H13ClN3Se.
What is the molecular weight of RefChem:403503?
The molecular weight of RefChem:403503 is 374.00 g/mol.
Where can I buy RefChem:403503?
You can request a quote for RefChem:403503 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:403503?
Yes, KEHONG BIO provides custom synthesis services for RefChem:403503 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.