N-benzyl-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)-N~2~-propylglycinamide
Chemical Structure Depiction of
N-benzyl-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)-N~2~-propylglycinamide
N-benzyl-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)-N~2~-propylglycinamide
Compound characteristics
| Compound ID: | V001-1539 |
| Compound Name: | N-benzyl-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)-N~2~-propylglycinamide |
| Molecular Weight: | 501.62 |
| Molecular Formula: | C24 H27 N3 O5 S2 |
| Smiles: | CCCN(CC(N(Cc1ccccc1)Cc1c(C)ccs1)=O)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8019 |
| logD: | 4.8019 |
| logSw: | -4.5172 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 81.676 |
| InChI Key: | MTJLMQMEURLBMO-UHFFFAOYSA-N |