UPCMLD0ENAT0513-8346:001
TL;DR: UPCMLD0ENAT0513-8346:001 (CAS 379243-86-4) is a chemical compound with molecular formula C15H16N4OS2 and molecular weight 332.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-piperidin-1-yl-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone
Also Known As: UPCMLD0ENAT0513-8346:001, F1174-2402, 1-piperidin-1-yl-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone, AF-399/40684400, 2-(benzo[4,5]thiazolo[2,3-c][1,2,4]triazol-3-ylthio)-1-(piperidin-1-yl)ethanone
| Molecular Formula | C15H16N4OS2 |
|---|---|
| Molecular Weight | 332.08 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.07657 |
| Heavy Atoms | 22 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 379243-86-4 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)CSC2=NN=C3N2C4=CC=CC=C4S3 |
| InChIKey | ZAMFFJXMWMFWBN-UHFFFAOYSA-N |
Product Overview
UPCMLD0ENAT0513-8346:001 (CAS 379243-86-4), with molecular formula C15H16N4OS2 and molecular weight 332.08 g/mol. IUPAC: 1-piperidin-1-yl-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-1-ylsulfanyl)ethanone.
Chemical Property Profile of UPCMLD0ENAT0513-8346:001
Property Insights of UPCMLD0ENAT0513-8346:001
The XLogP value of 3.9 indicates that UPCMLD0ENAT0513-8346:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0513-8346:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0513-8346:001 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 UPCMLD0ENAT0513-8346:001?
The CAS number of UPCMLD0ENAT0513-8346:001 is 379243-86-4.
What is the molecular formula of UPCMLD0ENAT0513-8346:001?
The molecular formula of UPCMLD0ENAT0513-8346:001 is C15H16N4OS2.
What is the molecular weight of UPCMLD0ENAT0513-8346:001?
The molecular weight of UPCMLD0ENAT0513-8346:001 is 332.08 g/mol.
Where can I buy UPCMLD0ENAT0513-8346:001?
You can request a quote for UPCMLD0ENAT0513-8346:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0513-8346:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0513-8346:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.