AC1M1ZMN
methyl 2-[[5-[[[4-(diethylsulfamoyl)benzoyl]amino]methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetate
Also Known As: F0601-0108|methyl 2-{[5-({[4-(diethylsulfamoyl)phenyl]formamido}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate|methyl ({5-[({4-[(diethylamino)sulfonyl]benzoyl}amino)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}thio)acetate|methyl 2-[[5-[[[4-(diethylsulfamoyl)benzoyl]amino]methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetate|methyl 2-((5-((4-(N,N-diethylsulfamoyl)benzamido)methyl)-4-methyl-4H-1,2,4-triazol-3-yl)thio)acetate
| Molecular Formula | C18H25N5O5S2 |
|---|---|
| Molecular Weight | 455.1297 g/mol |
| LogP | 1.0407 |
| Topological Polar Surface Area | 123.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 455.1297 |
| Monoisotopic Mass | 455.1297 |
| Heavy Atoms | 30 |
| Complexity | 984.89606 |
Chemical Identifiers
| CAS Number | 689751-79-9 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C)SCC(=O)OC |
Product Overview
AC1M1ZMN (CAS 689751-79-9), with molecular formula C18H25N5O5S2 and molecular weight 455.1297 g/mol. IUPAC: methyl 2-[[5-[[[4-(diethylsulfamoyl)benzoyl]amino]methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetate.