4-{[(4-bromobenzene-1-sulfonyl)amino]methyl}-N-(2,2-diethoxyethyl)benzamide
Chemical Structure Depiction of
4-{[(4-bromobenzene-1-sulfonyl)amino]methyl}-N-(2,2-diethoxyethyl)benzamide
4-{[(4-bromobenzene-1-sulfonyl)amino]methyl}-N-(2,2-diethoxyethyl)benzamide
Compound characteristics
| Compound ID: | K783-0140 |
| Compound Name: | 4-{[(4-bromobenzene-1-sulfonyl)amino]methyl}-N-(2,2-diethoxyethyl)benzamide |
| Molecular Weight: | 485.4 |
| Molecular Formula: | C20 H25 Br N2 O5 S |
| Smiles: | CCOC(CNC(c1ccc(CNS(c2ccc(cc2)[Br])(=O)=O)cc1)=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.0925 |
| logD: | 3.0923 |
| logSw: | -3.4411 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.336 |
| InChI Key: | CMSCNQDHOYKXGQ-UHFFFAOYSA-N |