N-benzyl-N~2~-(3-methoxypropyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)glycinamide
Chemical Structure Depiction of
N-benzyl-N~2~-(3-methoxypropyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)glycinamide
N-benzyl-N~2~-(3-methoxypropyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)glycinamide
Compound characteristics
| Compound ID: | V012-3007 |
| Compound Name: | N-benzyl-N~2~-(3-methoxypropyl)-N-[(3-methylthiophen-2-yl)methyl]-N~2~-(4-nitrobenzene-1-sulfonyl)glycinamide |
| Molecular Weight: | 531.65 |
| Molecular Formula: | C25 H29 N3 O6 S2 |
| Smiles: | Cc1ccsc1CN(Cc1ccccc1)C(CN(CCCOC)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1613 |
| logD: | 4.1613 |
| logSw: | -4.0912 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 90.018 |
| InChI Key: | UFPOCGZROHLLSC-UHFFFAOYSA-N |