F0630-0727
TL;DR: F0630-0727 (CAS 851801-93-9) is a chemical compound with molecular formula C21H22ClN3O3S2 and molecular weight 463.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(4-chlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone
Also Known As: F0630-0727, (2-((4-chlorobenzyl)thio)-4,5-dihydro-1H-imidazol-1-yl)(4-(pyrrolidin-1-ylsulfonyl)phenyl)methanone, 2-{[(4-chlorophenyl)methyl]sulfanyl}-1-[4-(pyrrolidine-1-sulfonyl)benzoyl]-4,5-dihydro-1H-imidazole, [2-[(4-chlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone
| Molecular Formula | C21H22ClN3O3S2 |
|---|---|
| Molecular Weight | 463.08 g/mol |
| LogP | 3.8697 |
| Topological Polar Surface Area | 70.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 463.0791 |
| Heavy Atoms | 30 |
| Complexity | 1047.909 |
Chemical Identifiers
| CAS Number | 851801-93-9 |
|---|---|
| SMILES | C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN=C3SCC4=CC=C(C=C4)Cl |
Product Overview
F0630-0727 (CAS 851801-93-9), with molecular formula C21H22ClN3O3S2 and molecular weight 463.08 g/mol. IUPAC: [2-[(4-chlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone.
Chemical Property Profile of F0630-0727
Property Insights of F0630-0727
The XLogP value of 3.8697 indicates that F0630-0727 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.05 Ų falls within the moderate polarity range, balancing permeability and solubility for F0630-0727. Following Lipinski's Rule of Five, F0630-0727 has 0 hydrogen bond donor(s) and 5 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 F0630-0727?
The CAS number of F0630-0727 is 851801-93-9.
What is the molecular formula of F0630-0727?
The molecular formula of F0630-0727 is C21H22ClN3O3S2.
What is the molecular weight of F0630-0727?
The molecular weight of F0630-0727 is 463.08 g/mol.
Where can I buy F0630-0727?
You can request a quote for F0630-0727 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0630-0727?
Yes, KEHONG BIO provides custom synthesis services for F0630-0727 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.