N-(butan-2-yl)-N~3~-(4-chlorobenzene-1-sulfonyl)-beta-alaninamide
Chemical Structure Depiction of
N-(butan-2-yl)-N~3~-(4-chlorobenzene-1-sulfonyl)-beta-alaninamide
N-(butan-2-yl)-N~3~-(4-chlorobenzene-1-sulfonyl)-beta-alaninamide
Compound characteristics
| Compound ID: | K781-2059 |
| Compound Name: | N-(butan-2-yl)-N~3~-(4-chlorobenzene-1-sulfonyl)-beta-alaninamide |
| Molecular Weight: | 318.82 |
| Molecular Formula: | C13 H19 Cl N2 O3 S |
| Smiles: | CCC(C)NC(CCNS(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4095 |
| logD: | 2.4095 |
| logSw: | -3.1292 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.023 |
| InChI Key: | OBJUUTBTIVQMQN-JTQLQIEISA-N |