AC1LDEM0
N-(3-aminopropyl)-4-methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-(2-oxo-azacyclotridec-1-yl)propyl]amino]propyl]benzenesulfonamide
Also Known As: N-(11-Amino-4,8-ditosyl-4,8-diazaundecyl)-12-dodecanolactam|Benzenesulfonamide, N-(3-aminopropyl)-4-methyl-N-[3-[[(4-methylphenyl)sulfonyl][3-(2-oxoazacyclotridec-1-yl)propyl]amino]propyl]-|N- -4-methyl-N-[3-[[ sulfonyl][3- propyl]amino]propyl]benzenesulfonamide|N-(3-((3-Aminopropyl)[(4-methylphenyl)sulfonyl]amino)propyl)-4-methyl-N-[3-(2-oxoazacyclotridecan-1-yl)propyl]benzenesulfonamide #|N-(3-aminopropyl)-4-methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-(2-oxo-azacyclotridec-1-yl)propyl]amino]propyl]benzenesulfonamide|N-(3-Aminopropyl)-4-methyl-N-[3-[[(4-methylphenyl)sulfonyl][3-(2-oxo-1-azacyclotridecan-1-yl)propyl]amino]propyl]benzenesulfonamide|N-{3-[N-(3-aminopropyl)4-methylbenzenesulfonamido]propyl}-4-methyl-N-[3-(2-oxo-1-azacyclotridecan-1-yl)propyl]benzene-1-sulfonamide
| Molecular Formula | C35H56N4O5S2 |
|---|---|
| Molecular Weight | 676.3692 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 15 |
| Exact Mass | 676.3692 |
| Monoisotopic Mass | 676.3692 |
| Heavy Atoms | 46 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 75422-06-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(CCCN)CCCN(CCCN2CCCCCCCCCCCC2=O)S(=O)(=O)C3=CC=C(C=C3)C |
| InChIKey | LSCGWDJOPYYCKP-UHFFFAOYSA-N |
Product Overview
AC1LDEM0 (CAS 75422-06-9), with molecular formula C35H56N4O5S2 and molecular weight 676.3692 g/mol. IUPAC: N-(3-aminopropyl)-4-methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-(2-oxo-azacyclotridec-1-yl)propyl]amino]propyl]benzenesulfonamide.