TL;DR: CTK6A7871 (CAS 2650855-99-3) is a chemical compound with molecular formula C24H39N3O4 and molecular weight 433.29407 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
CTK6A7871
11-[1-hydroxy-2-(3-methylbutylamino)ethyl]-8-propan-2-yl-2-oxa-7,10-diazabicyclo[11.2.2]heptadeca-1(15),13,16-triene-6,9-dione
Also Known As: 11-[1-Hydroxy-2-(3-methylbutylamino)ethyl]-8-propan-2-yl-2-oxa-7,10-diazabicyclo[11.2.2]heptadeca-1(15),13,16-triene-6,9-dione, 11-{1-hydroxy-2-[(3-methylbutyl)amino]ethyl}-8-(propan-2-yl)-2-oxa-7,10-diazabicyclo[11.2.2]heptadeca-1(15),13,16-triene-6,9-dione, 3-[1-hydroxy-2-(3-methylbutylamino)ethyl]-6-propan-2-yl-12-oxa-4,7-diazabicyclo[11.2.2]heptadeca-1(15),13,16-triene-5,8-dione
| Molecular Formula | C24H39N3O4 |
| Molecular Weight | 433.29407 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 99.7 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 433.29407 Da |
| Heavy Atoms | 31 |
| Complexity | 547.0 |
| SMILES | CC(C)CCNCC(C1CC2=CC=C(C=C2)OCCCC(=O)NC(C(=O)N1)C(C)C)O |
| InChIKey | IUDJFSQFSQZRNP-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CTK6A7871. The TPSA of 99.7 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK6A7871. Following Lipinski's Rule of Five, CTK6A7871 has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CTK6A7871 is 2650855-99-3.
The molecular formula of CTK6A7871 is C24H39N3O4.
The molecular weight of CTK6A7871 is 433.29407 g/mol.
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