TL;DR: CBKinase1_006353 (CAS 1008242-76-9) is a chemical compound with molecular formula C19H16ClF3N2O4S and molecular weight 460.04715 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(4-methylphenyl)sulfonyl-5-oxopyrrolidine-2-carboxamide
Also Known As: CBKinase1_006353, CBKinase1_018753, BRD-A35152806-001-01-9, N-[4-chloro-3-(trifluoromethyl)phenyl]-1-[(4-methylphenyl)sulfonyl]-5-oxoprolinamide, N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(4-methylphenyl)sulfonyl-5-oxopyrrolidine-2-carboxamide
| Molecular Formula | C19H16ClF3N2O4S |
| Molecular Weight | 460.04715 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 91.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 460.04715 Da |
| Heavy Atoms | 30 |
| Complexity | 763.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2=O)C(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F |
| InChIKey | JLILGKXDMIVDGY-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that CBKinase1_006353 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_006353. Following Lipinski's Rule of Five, CBKinase1_006353 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CBKinase1_006353 is 1008242-76-9.
The molecular formula of CBKinase1_006353 is C19H16ClF3N2O4S.
The molecular weight of CBKinase1_006353 is 460.04715 g/mol.
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