2-[2-(azepan-1-yl)-2-oxoethyl]-6-benzyl-1lambda~6~,2,6-thiadiazinane-1,1-dione
Chemical Structure Depiction of
2-[2-(azepan-1-yl)-2-oxoethyl]-6-benzyl-1lambda~6~,2,6-thiadiazinane-1,1-dione
2-[2-(azepan-1-yl)-2-oxoethyl]-6-benzyl-1lambda~6~,2,6-thiadiazinane-1,1-dione
Compound characteristics
| Compound ID: | G348-0451 |
| Compound Name: | 2-[2-(azepan-1-yl)-2-oxoethyl]-6-benzyl-1lambda~6~,2,6-thiadiazinane-1,1-dione |
| Molecular Weight: | 365.49 |
| Molecular Formula: | C18 H27 N3 O3 S |
| Smiles: | C1CCCN(CC1)C(CN1CCCN(Cc2ccccc2)S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8843 |
| logD: | 1.8843 |
| logSw: | -2.2672 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.102 |
| InChI Key: | ULXQPJHDTGIITE-UHFFFAOYSA-N |