3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione
TL;DR: 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione (CAS 103994-72-5) is a chemical compound with molecular formula C12H14N4O2S and molecular weight 278.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione
Also Known As: BIM-0032906.P001, 3-(morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione, A1861/0078246, 3-(morpholinomethyl)-5-(4-pyridyl)-1,3,4-oxadiazole-2-thione, 3-morpholinomethyl-5-(4-pyridyl)-1,3,4-oxadiazole-2(3h)-thione
| Molecular Formula | C12H14N4O2S |
|---|---|
| Molecular Weight | 278.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.08374 |
| Heavy Atoms | 19 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 103994-72-5 |
|---|---|
| SMILES | C1COCCN1CN2C(=S)OC(=N2)C3=CC=NC=C3 |
| InChIKey | OIPNGUYKODAHAN-UHFFFAOYSA-N |
Product Overview
3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione (CAS 103994-72-5), with molecular formula C12H14N4O2S and molecular weight 278.08 g/mol. IUPAC: 3-(morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione.
Chemical Property Profile of 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione
Property Insights of 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione. Following Lipinski's Rule of Five, 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione has 0 hydrogen bond donor(s) and 6 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 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione?
The CAS number of 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione is 103994-72-5.
What is the molecular formula of 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione?
The molecular formula of 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione is C12H14N4O2S.
What is the molecular weight of 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione?
The molecular weight of 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione is 278.08 g/mol.
Where can I buy 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione?
You can request a quote for 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-(Morpholin-4-ylmethyl)-5-pyridin-4-yl-1,3,4-oxadiazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.