N~3~,N~4~-dicyclooctyl-1-methyl-1H-pyrrole-3,4-disulfonamide
Chemical Structure Depiction of
N~3~,N~4~-dicyclooctyl-1-methyl-1H-pyrrole-3,4-disulfonamide
N~3~,N~4~-dicyclooctyl-1-methyl-1H-pyrrole-3,4-disulfonamide
Compound characteristics
| Compound ID: | K906-4871 |
| Compound Name: | N~3~,N~4~-dicyclooctyl-1-methyl-1H-pyrrole-3,4-disulfonamide |
| Molecular Weight: | 459.67 |
| Molecular Formula: | C21 H37 N3 O4 S2 |
| Smiles: | Cn1cc(c(c1)S(NC1CCCCCCC1)(=O)=O)S(NC1CCCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5518 |
| logD: | 4.5518 |
| logSw: | -4.2102 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.465 |
| InChI Key: | PYBSVVJRGDBHGP-UHFFFAOYSA-N |