TL;DR: BRD-K27133257-001-01-1 (CAS 142564-99-6) is a chemical compound with molecular formula C15H21N5S and molecular weight 303.15176 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-1-pyrazin-2-ylethylideneamino]-3-azabicyclo[3.2.2]nonane-3-carbothioamide
Also Known As: BRD-K27133257-001-01-1, 3-Azabicyclo(3.2.2)nonane-3-carbothioic acid, (1-pyrazinylethylidene)hydrazide, 3-Azabicyclo(3.2.2)nonane-3-carbothioic acid 2-(1-(2-pyrazinyl)ethylidene)hydrazide, 3-Azabicyclo(3.2.2)nonane-3-carbothioic acid, (1-pyrazinylethylidene)hydrazide, (E)-, 3-Azabicyclo(3.2.2)nonane-3-carbothioic acid, 2-(1-(2-pyrazinyl)ethylidene)hydrazide
| Molecular Formula | C15H21N5S |
| Molecular Weight | 303.15176 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 85.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 303.15176 Da |
| Heavy Atoms | 21 |
| Complexity | 389.0 |
| SMILES | C/C(=N\NC(=S)N1CC2CCC(C1)CC2)/C3=NC=CN=C3 |
| InChIKey | HCNCHPUSRLRNJS-WOJGMQOQSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BRD-K27133257-001-01-1. The TPSA of 85.5 Ų falls within the moderate polarity range, balancing permeability and solubility for BRD-K27133257-001-01-1. Following Lipinski's Rule of Five, BRD-K27133257-001-01-1 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 BRD-K27133257-001-01-1 is 142564-99-6.
The molecular formula of BRD-K27133257-001-01-1 is C15H21N5S.
The molecular weight of BRD-K27133257-001-01-1 is 303.15176 g/mol.
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