TL;DR: Sch 44643 (CAS 133330-43-5) is a chemical compound with molecular formula C25H23ClN3O2- and molecular weight 432.1479 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(13-chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-ylidene)piperidin-1-yl]-(1-oxido-2H-pyridin-4-yl)methanone
Also Known As: SCH 44643, [4-(13-Chloro-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-ylidene)piperidin-1-yl]-(1-oxido-2H-pyridin-4-yl)methanone, 4-(4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidine-1-carbonyl)pyridin-1(2H)-olate, 4-[4-(8-Chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)piperidine-1-carbonyl]pyridin-1(2H)-olate, CRC59W8HHV
| Molecular Formula | C25H23ClN3O2- |
| Molecular Weight | 432.1479 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 59.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 432.1479 Da |
| Heavy Atoms | 31 |
| Complexity | 782.0 |
| SMILES | C1CC2=C(C=CC(=C2)Cl)C(=C3CCN(CC3)C(=O)C4=CCN(C=C4)[O-])C5=C1C=CC=N5 |
| InChIKey | IJTLWVCXERQDJL-UHFFFAOYSA-N |
The XLogP value of 4.6 indicates that Sch 44643 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.5 Ų, Sch 44643 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Sch 44643 has 0 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 Sch 44643 is 133330-43-5.
The molecular formula of Sch 44643 is C25H23ClN3O2-.
The molecular weight of Sch 44643 is 432.1479 g/mol.
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