UPCMLD0ENAT5724532:001
TL;DR: UPCMLD0ENAT5724532:001 (CAS 311333-60-5) is a chemical compound with molecular formula C13H12F3N3OS and molecular weight 315.0653 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[3-cyano-6-methyl-4-(trifluoromethyl)-2-pyridinyl]sulfanyl]-N-cyclopropylacetamide
Also Known As: UPCMLD0ENAT5724532:001, 2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-cyclopropylacetamide, 2-((3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl)thio)-N-cyclopropylacetamide, 2-[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl-N-cyclopropylacetamide
Technical Specifications
| Molecular Formula | C13H12F3N3OS |
| Molecular Weight | 315.0653 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 91.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.0653 Da |
| Heavy Atoms | 21 |
| Complexity | 444.0 |
| SMILES | CC1=CC(=C(C(=N1)SCC(=O)NC2CC2)C#N)C(F)(F)F |
| InChIKey | HGVSQFGLYVSKKO-UHFFFAOYSA-N |
Chemical Property Profile of UPCMLD0ENAT5724532:001
Property Insights of UPCMLD0ENAT5724532:001
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5724532:001. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5724532:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5724532:001 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5724532:001?
The CAS number of UPCMLD0ENAT5724532:001 is 311333-60-5.
What is the molecular formula of UPCMLD0ENAT5724532:001?
The molecular formula of UPCMLD0ENAT5724532:001 is C13H12F3N3OS.
What is the molecular weight of UPCMLD0ENAT5724532:001?
The molecular weight of UPCMLD0ENAT5724532:001 is 315.0653 g/mol.
Where can I buy UPCMLD0ENAT5724532:001?
You can request a quote for UPCMLD0ENAT5724532:001 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for UPCMLD0ENAT5724532:001?
Yes, CoreyChem provides custom synthesis services for UPCMLD0ENAT5724532:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.