TL;DR: GR 54374X (CAS 135248-55-4) is a chemical compound with molecular formula C21H19NO3 and molecular weight 333.1365 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
16-hydroxy-3-methyl-11-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1,5,7,15(20),16,18-hexaene-14,21-dione
Also Known As: GR 54374X, GR-54374X, GR54374X, Benz(5,6)isoindolo(2,1-b)isoquinoline-8,13-dione, 4a,5,7,7a,14,14a-hexahydro-9-hydroxy-14-methyl-, 16-Hydroxy-3-methyl-11-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1,5,7,15(20),16,18-hexaene-14,21-dione
| Molecular Formula | C21H19NO3 |
| Molecular Weight | 333.1365 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 333.1365 Da |
| Heavy Atoms | 25 |
| Complexity | 733.0 |
| SMILES | CC1C2C=CC=CC2CN3C1=C4C(C3)C(=O)C5=C(C4=O)C=CC=C5O |
| InChIKey | KXBBWJKXRGCZIE-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that GR 54374X is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, GR 54374X exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, GR 54374X 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 GR 54374X is 135248-55-4.
The molecular formula of GR 54374X is C21H19NO3.
The molecular weight of GR 54374X is 333.1365 g/mol.
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