UPCMLD0ENAT5966912:001
TL;DR: UPCMLD0ENAT5966912:001 (CAS 271798-73-3) is a chemical compound with molecular formula C11H10F3N5OS and molecular weight 317.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-methyltetrazol-5-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide
Also Known As: UPCMLD0ENAT5966912:001, 2-[(1-methyl-1H-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-[3-(trifluoromethyl)phenyl]acetamide, AA-768/30961014, 2-((1-Methyl-1h-tetrazol-5-yl)thio)-N-(3-(trifluoromethyl)phenyl)acetamide, 2-(1-methyltetrazol-5-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide
| Molecular Formula | C11H10F3N5OS |
|---|---|
| Molecular Weight | 317.06 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 317.05582 |
| Heavy Atoms | 21 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 271798-73-3 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC(=O)NC2=CC=CC(=C2)C(F)(F)F |
| InChIKey | WYYOHIHESUZJDM-UHFFFAOYSA-N |
Product Overview
UPCMLD0ENAT5966912:001 (CAS 271798-73-3), with molecular formula C11H10F3N5OS and molecular weight 317.06 g/mol. IUPAC: 2-(1-methyltetrazol-5-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of UPCMLD0ENAT5966912:001
Property Insights of UPCMLD0ENAT5966912:001
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5966912:001. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5966912:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5966912:001 has 1 hydrogen bond donor(s) and 8 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 UPCMLD0ENAT5966912:001?
The CAS number of UPCMLD0ENAT5966912:001 is 271798-73-3.
What is the molecular formula of UPCMLD0ENAT5966912:001?
The molecular formula of UPCMLD0ENAT5966912:001 is C11H10F3N5OS.
What is the molecular weight of UPCMLD0ENAT5966912:001?
The molecular weight of UPCMLD0ENAT5966912:001 is 317.06 g/mol.
Where can I buy UPCMLD0ENAT5966912:001?
You can request a quote for UPCMLD0ENAT5966912:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5966912:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5966912:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.