TL;DR: Caulibugulone C (CAS 662167-17-1) is a chemical compound with molecular formula C10H7ClN2O2 and molecular weight 222.0196 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
Caulibugulone C
6-chloro-7-(methylamino)isoquinoline-5,8-dione
Also Known As: Caulibugulone C, UPCMLD00WCaulibugC, 6-chloro-7-(methylamino)isoquinoline-5,8-dione, CMLD4_000087, SDCCGMLS-0091594.P001
| Molecular Formula | C10H7ClN2O2 |
| Molecular Weight | 222.0196 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 59.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.0196 Da |
| Heavy Atoms | 15 |
| Complexity | 351.0 |
| SMILES | CNC1=C(C(=O)C2=C(C1=O)C=NC=C2)Cl |
| InChIKey | YIDGULDOJYFHGX-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Caulibugulone C. With a topological polar surface area (TPSA) of 59.1 Ų, Caulibugulone C exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Caulibugulone C 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 Caulibugulone C is 662167-17-1.
The molecular formula of Caulibugulone C is C10H7ClN2O2.
The molecular weight of Caulibugulone C is 222.0196 g/mol.
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