TL;DR: C15H20ClN3OS (CAS 1049732-27-5) is a chemical compound with molecular formula C15H20ClN3OS and molecular weight 325.10156 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1S)-2-methyl-1-[5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,3,4-oxadiazol-2-yl]propan-1-amine;hydrochloride
Also Known As: (S,E)-1-(5-(cinnamylthio)-1,3,4-oxadiazol-2-yl)-2-methylpropan-1-amine hydrochloride, (S)-2-Methyl-1-[5-((E)-3-phenyl-allylsulfanyl)-[1,3,4]oxadiazol-2-yl]-propylamine
| Molecular Formula | C15H20ClN3OS |
| Molecular Weight | 325.10156 g/mol |
| XLogP | 3.9527 |
| Topological Polar Surface Area (TPSA) | 90.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 325.10156 Da |
| Heavy Atoms | 21 |
| Complexity | 305.0 |
| SMILES | CC(C)[C@@H](C1=NN=C(O1)SC/C=C/C2=CC=CC=C2)N.Cl |
| InChIKey | AAHBVAOSMBHHMR-MYUUFBJNSA-N |
The XLogP value of 3.9527 indicates that C15H20ClN3OS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.2 Ų falls within the moderate polarity range, balancing permeability and solubility for C15H20ClN3OS. Following Lipinski's Rule of Five, C15H20ClN3OS has 2 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 C15H20ClN3OS is 1049732-27-5.
The molecular formula of C15H20ClN3OS is C15H20ClN3OS.
The molecular weight of C15H20ClN3OS is 325.10156 g/mol.
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