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C15H20ClN3OS structure
Fine Chemical

C15H20ClN3OS

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

CAS Number
1049732-27-5
Molecular Formula
C15H20ClN3OS
Molecular Weight
325.10156 g/mol
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Technical Specifications

Molecular FormulaC15H20ClN3OS
Molecular Weight325.10156 g/mol
XLogP3.9527
Topological Polar Surface Area (TPSA)90.2 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds6
Exact Mass325.10156 Da
Heavy Atoms21
Complexity305.0
SMILESCC(C)[C@@H](C1=NN=C(O1)SC/C=C/C2=CC=CC=C2)N.Cl
InChIKeyAAHBVAOSMBHHMR-MYUUFBJNSA-N

Chemical Property Profile of C15H20ClN3OS

XLogP
3.9527
TPSA (Topological Polar Surface Area)
90.2
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
6
Heavy Atoms
21
Complexity
305.0
Exact Mass
325.10156
Monoisotopic Mass
325.10156
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of C15H20ClN3OS

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.

Frequently Asked Questions

What is the CAS number of C15H20ClN3OS?

The CAS number of C15H20ClN3OS is 1049732-27-5.

What is the molecular formula of C15H20ClN3OS?

The molecular formula of C15H20ClN3OS is C15H20ClN3OS.

What is the molecular weight of C15H20ClN3OS?

The molecular weight of C15H20ClN3OS is 325.10156 g/mol.

Where can I buy C15H20ClN3OS?

You can request a quote for C15H20ClN3OS directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for C15H20ClN3OS?

Yes, CoreyChem provides custom synthesis services for C15H20ClN3OS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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