TL;DR: Naltriben (CAS 111555-58-9) is a chemical compound with molecular formula C26H25NO4 and molecular weight 415.17834 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
22-(cyclopropylmethyl)-11,14-dioxa-22-azaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5,7,9,15,17,19(25)-heptaene-2,16-diol
Also Known As: Naltriben, Naltriben mesylate, naltrindole benzofuran, BRD-A21723284-066-01-7, 22-(Cyclopropylmethyl)-11,14-dioxa-22-azaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5,7,9,15,17,19(25)-heptaene-2,16-diol
| Molecular Formula | C26H25NO4 |
| Molecular Weight | 415.17834 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 66.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 415.17834 Da |
| Heavy Atoms | 31 |
| Complexity | 773.0 |
| SMILES | C1CC1CN2CCC34C5C6=C(CC3(C2CC7=C4C(=C(C=C7)O)O5)O)C8=CC=CC=C8O6 |
| InChIKey | ZHVWWEYETMPAMX-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that Naltriben is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Naltriben. Following Lipinski's Rule of Five, Naltriben has 2 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 Naltriben is 111555-58-9.
The molecular formula of Naltriben is C26H25NO4.
The molecular weight of Naltriben is 415.17834 g/mol.
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