8L-950
TL;DR: 8L-950 (CAS 339101-88-1) is a chemical compound with molecular formula C22H21ClN2O3S and molecular weight 428.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[(4-chlorophenyl)sulfonylmethyl]-4-pyrrol-1-ylphenyl]-pyrrolidin-1-ylmethanone
Also Known As: 8L-950, [3-{[(4-chlorophenyl)sulfonyl]methyl}-4-(1H-pyrrol-1-yl)phenyl](1-pyrrolidinyl)methanone, [3-[(4-chlorophenyl)sulfonylmethyl]-4-pyrrol-1-ylphenyl]-pyrrolidin-1-ylmethanone, 1-{2-[(4-chlorobenzenesulfonyl)methyl]-4-(pyrrolidine-1-carbonyl)phenyl}-1H-pyrrole, [3-([(4-CHLOROPHENYL)SULFONYL]METHYL)-4-(1H-PYRROL-1-YL)PHENYL](1-PYRROLIDINYL)METHANONE
| Molecular Formula | C22H21ClN2O3S |
|---|---|
| Molecular Weight | 428.10 g/mol |
| LogP | 4.3406 |
| Topological Polar Surface Area | 59.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.09613 |
| Heavy Atoms | 29 |
| Complexity | 1117.3739 |
Chemical Identifiers
| CAS Number | 339101-88-1 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C2=CC(=C(C=C2)N3C=CC=C3)CS(=O)(=O)C4=CC=C(C=C4)Cl |
Product Overview
8L-950 (CAS 339101-88-1), with molecular formula C22H21ClN2O3S and molecular weight 428.10 g/mol. IUPAC: [3-[(4-chlorophenyl)sulfonylmethyl]-4-pyrrol-1-ylphenyl]-pyrrolidin-1-ylmethanone.
Chemical Property Profile of 8L-950
Property Insights of 8L-950
The XLogP value of 4.3406 indicates that 8L-950 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.38 Ų, 8L-950 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8L-950 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 8L-950?
The CAS number of 8L-950 is 339101-88-1.
What is the molecular formula of 8L-950?
The molecular formula of 8L-950 is C22H21ClN2O3S.
What is the molecular weight of 8L-950?
The molecular weight of 8L-950 is 428.10 g/mol.
Where can I buy 8L-950?
You can request a quote for 8L-950 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8L-950?
Yes, KEHONG BIO provides custom synthesis services for 8L-950 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.