N-benzyl-N~2~-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)glycinamide
Chemical Structure Depiction of
N-benzyl-N~2~-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)glycinamide
N-benzyl-N~2~-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)glycinamide
Compound characteristics
| Compound ID: | V001-1748 |
| Compound Name: | N-benzyl-N~2~-(2-methylpropyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)glycinamide |
| Molecular Weight: | 515.65 |
| Molecular Formula: | C25 H29 N3 O5 S2 |
| Smiles: | CC(C)CN(CC(N(Cc1ccccc1)Cc1c(C)ccs1)=O)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2018 |
| logD: | 5.2018 |
| logSw: | -5.0044 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.697 |
| InChI Key: | PJUVRJDMXJPQFI-UHFFFAOYSA-N |