TL;DR: Sdz pco 400 (CAS 121055-10-5) is a chemical compound with molecular formula C17H17NO4 and molecular weight 299.11575 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-2,2-dimethyl-4-(3-oxocyclopenten-1-yl)oxy-3,4-dihydrochromene-6-carbonitrile
Also Known As: Sdz pco 400, Sdz pco-400, PCO 400, SDZ-PCO-400, 3,4-Dihydro-3-hydroxy-2,2-dimethyl-4-(3-oxo-cyclopent-1-enyloxy)-2H-1-benzopyran-6-carbonitrile
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C17H17NO4 |
| Molecular Weight | 299.11575 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 79.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 299.11575 Da |
| Heavy Atoms | 22 |
| Complexity | 544.0 |
| SMILES | CC1(C(C(C2=C(O1)C=CC(=C2)C#N)OC3=CC(=O)CC3)O)C |
| InChIKey | WJBHHTPFTVKZCV-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sdz pco 400. The TPSA of 79.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Sdz pco 400. Following Lipinski's Rule of Five, Sdz pco 400 has 1 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 Sdz pco 400 is 121055-10-5.
The molecular formula of Sdz pco 400 is C17H17NO4.
The molecular weight of Sdz pco 400 is 299.11575 g/mol.
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