![1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione structure](/static/products/6867/6867-22-7.webp)
1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione
TL;DR: 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione (CAS 6867-22-7) is a chemical compound with molecular formula C25H18ClF3N2O2S and molecular weight 502.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-phenylsulfanylpyrrole-2,5-dione
Also Known As: 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione, 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-phenylsulfanylpyrrole-2,5-dione
| Molecular Formula | C25H18ClF3N2O2S |
|---|---|
| Molecular Weight | 502.07 g/mol |
| LogP | 6.96484 |
| Topological Polar Surface Area | 49.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 502.07297 |
| Heavy Atoms | 34 |
| Complexity | 1323.4812 |
Chemical Identifiers
| CAS Number | 6867-22-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=C(C(=O)N(C2=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)SC4=CC=CC=C4)C |
Product Overview
1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione (CAS 6867-22-7), with molecular formula C25H18ClF3N2O2S and molecular weight 502.07 g/mol. IUPAC: 1-[2-chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-phenylsulfanylpyrrole-2,5-dione.
Chemical Property Profile of 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione
Property Insights of 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione
The XLogP value of 6.96484 indicates that 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.41 Ų, 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione?
The CAS number of 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione is 6867-22-7.
What is the molecular formula of 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione?
The molecular formula of 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione is C25H18ClF3N2O2S.
What is the molecular weight of 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione?
The molecular weight of 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione is 502.07 g/mol.
Where can I buy 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione?
You can request a quote for 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-Chloro-5-(trifluoromethyl)phenyl]-3-(3,4-dimethylanilino)-4-(phenylsulfanyl)-1H-pyrrole-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.