![2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide structure](/static/products/478/478047-87-9.png)
2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide
TL;DR: 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide (CAS 478047-87-9) is a chemical compound with molecular formula C19H15ClN2S and molecular weight 338.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-chlorophenyl)methylsulfanyl]-5,6-dihydrobenzo[h]cinnoline
Also Known As: 2-chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide, 3-{[(2-chlorophenyl)methyl]sulfanyl}-5H,6H-benzo[h]cinnoline, 3-[(2-chlorophenyl)methylsulfanyl]-5,6-dihydrobenzo[h]cinnoline, REGID_for_CID_6404504
| Molecular Formula | C19H15ClN2S |
|---|---|
| Molecular Weight | 338.06 g/mol |
| LogP | 5.1879 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.06445 |
| Heavy Atoms | 23 |
| Complexity | 863.4934 |
Chemical Identifiers
| CAS Number | 478047-87-9 |
|---|---|
| SMILES | C1CC2=CC(=NN=C2C3=CC=CC=C31)SCC4=CC=CC=C4Cl |
Product Overview
2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide (CAS 478047-87-9), with molecular formula C19H15ClN2S and molecular weight 338.06 g/mol. IUPAC: 3-[(2-chlorophenyl)methylsulfanyl]-5,6-dihydrobenzo[h]cinnoline.
Chemical Property Profile of 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide
Property Insights of 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide
The XLogP value of 5.1879 indicates that 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide?
The CAS number of 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide is 478047-87-9.
What is the molecular formula of 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide?
The molecular formula of 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide is C19H15ClN2S.
What is the molecular weight of 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide?
The molecular weight of 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide is 338.06 g/mol.
Where can I buy 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide?
You can request a quote for 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 2-Chlorobenzyl 5,6-dihydrobenzo[h]cinnolin-3-yl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.