N-[(furan-2-yl)methyl]-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide
N-[(furan-2-yl)methyl]-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | K781-4661 |
| Compound Name: | N-[(furan-2-yl)methyl]-N~3~-(4-methylbenzene-1-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 322.38 |
| Molecular Formula: | C15 H18 N2 O4 S |
| Smiles: | Cc1ccc(cc1)S(NCCC(NCc1ccco1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3933 |
| logD: | 2.3932 |
| logSw: | -2.8967 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.058 |
| InChI Key: | WUEKMGVFKQGAJY-UHFFFAOYSA-N |