AC1L5ZJX
3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N,N-dimethylpropanamide;ethanesulfonic acid
Also Known As: 3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N,|ethanesulfonic acid- 3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenyl]-n,n-dimethylpropanamide(1:1)|3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N,N-dimethyl-propanamide|3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N,N-dimethylpropanamide; ethanesulfonic acid|3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N,N-dimethylpropanamide;ethanesulfonic acid|Ethanesulfonic acid--3-[4-(4,6-diimino-2,2-dimethyl-1,3,5-triazinan-1-yl)phenyl]-N,N-dimethylpropanamide (1/1)
| Molecular Formula | C18H30N6O4S |
|---|---|
| Molecular Weight | 426.20493 g/mol |
| LogP | 0.787 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 426.20493 |
| Monoisotopic Mass | 426.20493 |
| Heavy Atoms | 29 |
| Complexity | 608.0 |
Chemical Identifiers
| CAS Number | 50874-31-2 |
|---|---|
| SMILES | CCS(=O)(=O)O.CC1(N=C(N=C(N1C2=CC=C(C=C2)CCC(=O)N(C)C)N)N)C |
| InChIKey | IRWDEHQDVFZNCI-UHFFFAOYSA-N |
Product Overview
AC1L5ZJX (CAS 50874-31-2), with molecular formula C18H30N6O4S and molecular weight 426.20493 g/mol. IUPAC: 3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N,N-dimethylpropanamide;ethanesulfonic acid.