3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione
TL;DR: 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione (CAS 303034-91-5) is a chemical compound with molecular formula C18H15ClN2O2 and molecular weight 326.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-(N-methylanilino)-1-(2-methylphenyl)pyrrole-2,5-dione
Also Known As: AF-399/14183719, 3-chloro-1-(2-methylphenyl)-4-(methylphenylamino)azoline-2,5-dione, 3-chloro-4-(N-methylanilino)-1-(2-methylphenyl)pyrrole-2,5-dione, 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione, 3-chloro-4-(methyl(phenyl)amino)-1-(o-tolyl)-1H-pyrrole-2,5-dione
| Molecular Formula | C18H15ClN2O2 |
|---|---|
| Molecular Weight | 326.08 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 326.0822 |
| Heavy Atoms | 23 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 303034-91-5 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=O)C(=C(C2=O)Cl)N(C)C3=CC=CC=C3 |
| InChIKey | UDDSQPNLYADJBP-UHFFFAOYSA-N |
Product Overview
3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione (CAS 303034-91-5), with molecular formula C18H15ClN2O2 and molecular weight 326.08 g/mol. IUPAC: 3-chloro-4-(N-methylanilino)-1-(2-methylphenyl)pyrrole-2,5-dione.
Chemical Property Profile of 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione
Property Insights of 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione
The XLogP value of 4.1 indicates that 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-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 40.6 Ų, 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione has 0 hydrogen bond donor(s) and 3 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 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione?
The CAS number of 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione is 303034-91-5.
What is the molecular formula of 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione?
The molecular formula of 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione is C18H15ClN2O2.
What is the molecular weight of 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione?
The molecular weight of 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione is 326.08 g/mol.
Where can I buy 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione?
You can request a quote for 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-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 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-1-(2-methylphenyl)-4-[methyl(phenyl)amino]-1H-pyrrole-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.