N-benzyl-4-{[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]amino}benzene-1-sulfonamide
Chemical Structure Depiction of
N-benzyl-4-{[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]amino}benzene-1-sulfonamide
N-benzyl-4-{[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]amino}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8003-3804 |
| Compound Name: | N-benzyl-4-{[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]amino}benzene-1-sulfonamide |
| Molecular Weight: | 416.48 |
| Molecular Formula: | C18 H16 N4 O4 S2 |
| Smiles: | C(c1ccccc1)NS(c1ccc(cc1)NC=C1C(NC(NC1=O)=S)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3674 |
| logD: | 1.9337 |
| logSw: | -2.8528 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 102.985 |
| InChI Key: | RLKJNDGTKNSXSK-UHFFFAOYSA-N |