RefChem:1083115
TL;DR: RefChem:1083115 (CAS 102504-39-2) is a chemical compound with molecular formula C15H22Cl2N3O- and molecular weight 330.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-5-yl]-N,N-diethylpropan-1-amine chloride
Also Known As: delta(sup 4)-1,2,4-Oxadiazoline, 5-(3-(diethylamino)propyl)-3-(p-chlorophenyl)-, hydrochloride, 3-[2-(4-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-5-yl]-N,N-diethylpropan-1-amine;chloride, 5-(3-(Diethylamino)propyl)-3-(p-chlorophenyl)-delta(sup 4)-1,2,4-oxadiazoline hydrochloride, DELTA(SUP 4)-1,2,4-OXADIAZOLINE, 5-(3-(DIETHYLAMINO)PROPYL)-3-(P-CHLOR OPHENYL)-, HYDROCHLORIDE, N-ethyl-N-[(2-phenyl-2,3-dihydro-1,3,4-oxadiazol-5-yl)methyl]ethanamine chloride
| Molecular Formula | C15H22Cl2N3O- |
|---|---|
| Molecular Weight | 330.11 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 330.11398 |
| Heavy Atoms | 21 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 102504-39-2 |
|---|---|
| SMILES | CCN(CC)CCCC1=NNC(O1)C2=CC=C(C=C2)Cl.[Cl-] |
| InChIKey | DCFAHXHYLDHEFX-UHFFFAOYSA-M |
Product Overview
RefChem:1083115 (CAS 102504-39-2), with molecular formula C15H22Cl2N3O- and molecular weight 330.11 g/mol. IUPAC: 3-[2-(4-chlorophenyl)-2,3-dihydro-1,3,4-oxadiazol-5-yl]-N,N-diethylpropan-1-amine chloride.
Chemical Property Profile of RefChem:1083115
Property Insights of RefChem:1083115
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:1083115. With a topological polar surface area (TPSA) of 36.9 Ų, RefChem:1083115 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1083115 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1083115?
The CAS number of RefChem:1083115 is 102504-39-2.
What is the molecular formula of RefChem:1083115?
The molecular formula of RefChem:1083115 is C15H22Cl2N3O-.
What is the molecular weight of RefChem:1083115?
The molecular weight of RefChem:1083115 is 330.11 g/mol.
Where can I buy RefChem:1083115?
You can request a quote for RefChem:1083115 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1083115?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1083115 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.