AC1Q6X6I
N-benzyl-3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N-methylpropanamide;ethanesulfonic acid
Also Known As: N-benzyl-3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)p|ethanesulfonic acid- n-benzyl-3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2h)-yl)phenyl]-n-methylpropanamide(1:1)|N-benzyl-3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N-methyl-propanamide|Ethanesulfonic acid--N-benzyl-3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenyl]-N-methylpropanamide (1/1)|N-benzyl-3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N-methylpropanamide; ethanesulfonic acid|N-benzyl-3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N-methylpropanamide;ethanesulfonic acid
| Molecular Formula | C24H34N6O4S |
|---|---|
| Molecular Weight | 502.23624 g/mol |
| LogP | 2.3574 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 502.23624 |
| Monoisotopic Mass | 502.23624 |
| Heavy Atoms | 35 |
| Complexity | 734.0 |
Chemical Identifiers
| CAS Number | 50876-32-9 |
|---|---|
| SMILES | CCS(=O)(=O)O.CC1(N=C(N=C(N1C2=CC=C(C=C2)CCC(=O)N(C)CC3=CC=CC=C3)N)N)C |
| InChIKey | OKMMSHIEMAESNN-UHFFFAOYSA-N |
Product Overview
AC1Q6X6I (CAS 50876-32-9), with molecular formula C24H34N6O4S and molecular weight 502.23624 g/mol. IUPAC: N-benzyl-3-[4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]-N-methylpropanamide;ethanesulfonic acid.