TL;DR: CBKinase1_004377 (CAS 1008282-74-3) is a chemical compound with molecular formula C24H24N2O3S and molecular weight 420.15076 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
Also Known As: CBKinase1_004377, CBKinase1_016777, BRD-A16479617-001-01-8, N-(4-methylphenyl)-2-[(4-methylphenyl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxamide, N-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
| Molecular Formula | C24H24N2O3S |
| Molecular Weight | 420.15076 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.15076 Da |
| Heavy Atoms | 30 |
| Complexity | 688.0 |
| SMILES | CC1=CC=C(C=C1)NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)C |
| InChIKey | RNWQYLOTRLJOFP-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that CBKinase1_004377 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for CBKinase1_004377. Following Lipinski's Rule of Five, CBKinase1_004377 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CBKinase1_004377 is 1008282-74-3.
The molecular formula of CBKinase1_004377 is C24H24N2O3S.
The molecular weight of CBKinase1_004377 is 420.15076 g/mol.
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