N-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}-4-methylbenzene-1-sulfonamide
N-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y020-1844 |
| Compound Name: | N-{5-[(2H-1,3-benzodioxol-5-yl)methyl]-1,4,5,6-tetrahydro-1,3,5-triazin-2-yl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 388.44 |
| Molecular Formula: | C18 H20 N4 O4 S |
| Smiles: | Cc1ccc(cc1)S(NC1NCN(Cc2ccc3c(c2)OCO3)CN=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6845 |
| logD: | 2.6845 |
| logSw: | -3.1803 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.897 |
| InChI Key: | OJKMPZRQPUGZLW-UHFFFAOYSA-N |