N-(4-bromophenyl)-2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetamide
N-(4-bromophenyl)-2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | K261-2579 |
| Compound Name: | N-(4-bromophenyl)-2-[(4-butyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 482.42 |
| Molecular Formula: | C19 H20 Br N3 O3 S2 |
| Smiles: | CCCCN1C(=NS(c2ccccc12)(=O)=O)SCC(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7076 |
| logD: | 4.7075 |
| logSw: | -4.1057 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.113 |
| InChI Key: | XMGUJBPYTYGZPH-UHFFFAOYSA-N |