TL;DR: F2650-0721 (CAS 886932-52-1) is a chemical compound with molecular formula C22H21N5OS and molecular weight 403.14667 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-methylphenyl)-2-[[5-(3-methylphenyl)-4-pyrrol-1-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: F2650-0721, N-(2-methylphenyl)-2-{[5-(3-methylphenyl)-4-(1H-pyrrol-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide, 2-((4-(1H-pyrrol-1-yl)-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(o-tolyl)acetamide, N-(2-methylphenyl)-2-[[5-(3-methylphenyl)-4-pyrrol-1-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C22H21N5OS |
| Molecular Weight | 403.14667 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 90.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 403.14667 Da |
| Heavy Atoms | 29 |
| Complexity | 543.0 |
| SMILES | CC1=CC(=CC=C1)C2=NN=C(N2N3C=CC=C3)SCC(=O)NC4=CC=CC=C4C |
| InChIKey | IFLRNIPYMBLGPS-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that F2650-0721 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.0 Ų falls within the moderate polarity range, balancing permeability and solubility for F2650-0721. Following Lipinski's Rule of Five, F2650-0721 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of F2650-0721 is 886932-52-1.
The molecular formula of F2650-0721 is C22H21N5OS.
The molecular weight of F2650-0721 is 403.14667 g/mol.
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