1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione
TL;DR: 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione (CAS 16618-42-1) is a chemical compound with molecular formula C12H15N5OS and molecular weight 277.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione
Also Known As: DivK1c_004820, CDS1_003780, BIM-0017364.P001, 1-(morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione, AB00080408-01
| Molecular Formula | C12H15N5OS |
|---|---|
| Molecular Weight | 277.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 75.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.09973 |
| Heavy Atoms | 19 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 16618-42-1 |
|---|---|
| SMILES | C1COCCN1CN2C(=S)N(N=N2)C3=CC=CC=C3 |
| InChIKey | XYVZGYCOZUCJEQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione (CAS 16618-42-1), with molecular formula C12H15N5OS and molecular weight 277.10 g/mol. IUPAC: 1-(morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione.
Chemical Property Profile of 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione
Property Insights of 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione. The TPSA of 75.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione. Following Lipinski's Rule of Five, 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione has 0 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 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione?
The CAS number of 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione is 16618-42-1.
What is the molecular formula of 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione?
The molecular formula of 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione is C12H15N5OS.
What is the molecular weight of 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione?
The molecular weight of 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione is 277.10 g/mol.
Where can I buy 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione?
You can request a quote for 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione?
Yes, KEHONG BIO provides custom synthesis services for 1-(Morpholin-4-ylmethyl)-4-phenyltetrazole-5-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.