TL;DR: F0417-0403 (CAS 392294-09-6) is a chemical compound with molecular formula C22H18N4O3S2 and molecular weight 450.08203 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide
Also Known As: F0417-0403, N-(5-((2-((4-methoxyphenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-1-naphthamide, N-[5-({[(4-methoxyphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide, N-[5-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide, N-[5-[(4-methoxyphenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide
| Molecular Formula | C22H18N4O3S2 |
| Molecular Weight | 450.08203 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 147.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 450.08203 Da |
| Heavy Atoms | 31 |
| Complexity | 618.0 |
| SMILES | COC1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=CC4=CC=CC=C43 |
| InChIKey | DUWJIQIDMWOXSW-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that F0417-0403 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 147.0 Ų indicates high polarity, suggesting F0417-0403 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, F0417-0403 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of F0417-0403 is 392294-09-6.
The molecular formula of F0417-0403 is C22H18N4O3S2.
The molecular weight of F0417-0403 is 450.08203 g/mol.
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