9-bromo-6-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione
Chemical Structure Depiction of
9-bromo-6-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione
9-bromo-6-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione
Compound characteristics
| Compound ID: | D289-0197 |
| Compound Name: | 9-bromo-6-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-5lambda~6~-dibenzo[c,e][1,2]thiazine-5,5(6H)-dione |
| Molecular Weight: | 464.38 |
| Molecular Formula: | C20 H22 Br N3 O3 S |
| Smiles: | CCN1CCN(CC1)C(CN1c2ccc(cc2c2ccccc2S1(=O)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.7315 |
| logD: | 2.5553 |
| logSw: | -3.4607 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.691 |
| InChI Key: | VDWIJWHZEKYUHR-UHFFFAOYSA-N |