8R-1003
TL;DR: 8R-1003 (CAS 478260-27-4) is a chemical compound with molecular formula C21H24FN3O3S and molecular weight 417.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-fluoro-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]phenyl]cyclopropanecarboxamide
Also Known As: 8R-1003, N-(3-fluoro-4-{4-[(4-methylphenyl)sulfonyl]piperazino}phenyl)cyclopropanecarboxamide, N-[3-fluoro-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]phenyl]cyclopropanecarboxamide, N-{3-fluoro-4-[4-(4-methylbenzenesulfonyl)piperazin-1-yl]phenyl}cyclopropanecarboxamide
| Molecular Formula | C21H24FN3O3S |
|---|---|
| Molecular Weight | 417.15 g/mol |
| LogP | 2.99352 |
| Topological Polar Surface Area | 69.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.15225 |
| Heavy Atoms | 29 |
| Complexity | 1011.96686 |
Chemical Identifiers
| CAS Number | 478260-27-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4CC4)F |
Product Overview
8R-1003 (CAS 478260-27-4), with molecular formula C21H24FN3O3S and molecular weight 417.15 g/mol. IUPAC: N-[3-fluoro-4-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]phenyl]cyclopropanecarboxamide.
Chemical Property Profile of 8R-1003
Property Insights of 8R-1003
The XLogP value of 2.99352 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8R-1003. The TPSA of 69.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 8R-1003. Following Lipinski's Rule of Five, 8R-1003 has 1 hydrogen bond donor(s) and 4 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 8R-1003?
The CAS number of 8R-1003 is 478260-27-4.
What is the molecular formula of 8R-1003?
The molecular formula of 8R-1003 is C21H24FN3O3S.
What is the molecular weight of 8R-1003?
The molecular weight of 8R-1003 is 417.15 g/mol.
Where can I buy 8R-1003?
You can request a quote for 8R-1003 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8R-1003?
Yes, KEHONG BIO provides custom synthesis services for 8R-1003 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.