SID:96099911
TL;DR: SID:96099911 (CAS 158102-92-2) is a chemical compound with molecular formula C28H24ClF3N2O6S and molecular weight 608.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[[(3R,4R)-6-[(7-chloroquinolin-2-yl)methoxy]-4-hydroxy-3,4-dihydro-2H-chromen-3-yl]methyl]-4-methoxyphenyl]-1,1,1-trifluoromethanesulfonamide
Also Known As: SID:96099911, J1.185.770A, Methanesulfonamide, N-(3-(((3R,4R)-6-((7-chloro-2-quinolinyl)methoxy)-3,4-dihydro-4-hydroxy-2H-1-benzopyran-3-yl)methyl)-4-methoxyphenyl)-1,1,1-trifluoro-, 158102-92-2 (CP-199330), Methanesulfonamide, N-(3-((6-((7-chloro-2-quinolinyl)methoxy)-3,4-dihydro-4-hydroxy-2H-1-benzopyran-3-yl)methyl)-4-methoxyphenyl)-1,1,1-trifluoro-, (3R-cis)-
| Molecular Formula | C28H24ClF3N2O6S |
|---|---|
| Molecular Weight | 608.10 g/mol |
| LogP | 6.022 |
| Topological Polar Surface Area | 106.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 608.09955 |
| Heavy Atoms | 41 |
| Complexity | 1700.5526 |
Chemical Identifiers
| CAS Number | 158102-92-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)NS(=O)(=O)C(F)(F)F)C[C@@H]2COC3=C([C@@H]2O)C=C(C=C3)OCC4=NC5=C(C=CC(=C5)Cl)C=C4 |
Product Overview
SID:96099911 (CAS 158102-92-2), with molecular formula C28H24ClF3N2O6S and molecular weight 608.10 g/mol. IUPAC: N-[3-[[(3R,4R)-6-[(7-chloroquinolin-2-yl)methoxy]-4-hydroxy-3,4-dihydro-2H-chromen-3-yl]methyl]-4-methoxyphenyl]-1,1,1-trifluoromethanesulfonamide.
Chemical Property Profile of SID:96099911
Property Insights of SID:96099911
The XLogP value of 6.022 indicates that SID:96099911 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.98 Ų falls within the moderate polarity range, balancing permeability and solubility for SID:96099911. Following Lipinski's Rule of Five, SID:96099911 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SID:96099911?
The CAS number of SID:96099911 is 158102-92-2.
What is the molecular formula of SID:96099911?
The molecular formula of SID:96099911 is C28H24ClF3N2O6S.
What is the molecular weight of SID:96099911?
The molecular weight of SID:96099911 is 608.10 g/mol.
Where can I buy SID:96099911?
You can request a quote for SID:96099911 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SID:96099911?
Yes, KEHONG BIO provides custom synthesis services for SID:96099911 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.