4P-349S
TL;DR: 4P-349S (CAS 478044-94-9) is a chemical compound with molecular formula C22H15ClF3N3S and molecular weight 445.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(2-chlorophenyl)methylsulfanyl]-1H-indol-3-yl]-[3-(trifluoromethyl)phenyl]diazene
Also Known As: 4P-349S, 2-[(2-chlorobenzyl)sulfanyl]-3H-indol-3-one N-[3-(trifluoromethyl)phenyl]hydrazone, (3Z)-2-{[(2-chlorophenyl)methyl]sulfanyl}-3-{2-[3-(trifluoromethyl)phenyl]hydrazin-1-ylidene}-3H-indole, [2-[(2-chlorophenyl)methylsulfanyl]-1H-indol-3-yl]-[3-(trifluoromethyl)phenyl]diazene, N-[[2-[(2-chlorophenyl)methylsulfanyl]indol-3-ylidene]amino]-3-(trifluoromethyl)aniline
| Molecular Formula | C22H15ClF3N3S |
|---|---|
| Molecular Weight | 445.06 g/mol |
| LogP | 8.5478 |
| Topological Polar Surface Area | 40.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 445.06274 |
| Heavy Atoms | 30 |
| Complexity | 1217.7051 |
Chemical Identifiers
| CAS Number | 478044-94-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CSC2=C(C3=CC=CC=C3N2)N=NC4=CC=CC(=C4)C(F)(F)F)Cl |
Product Overview
4P-349S (CAS 478044-94-9), with molecular formula C22H15ClF3N3S and molecular weight 445.06 g/mol. IUPAC: [2-[(2-chlorophenyl)methylsulfanyl]-1H-indol-3-yl]-[3-(trifluoromethyl)phenyl]diazene.
Chemical Property Profile of 4P-349S
Property Insights of 4P-349S
The XLogP value of 8.5478 indicates that 4P-349S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.51 Ų, 4P-349S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4P-349S has 1 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 4P-349S?
The CAS number of 4P-349S is 478044-94-9.
What is the molecular formula of 4P-349S?
The molecular formula of 4P-349S is C22H15ClF3N3S.
What is the molecular weight of 4P-349S?
The molecular weight of 4P-349S is 445.06 g/mol.
Where can I buy 4P-349S?
You can request a quote for 4P-349S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4P-349S?
Yes, KEHONG BIO provides custom synthesis services for 4P-349S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.