6-ethyl-5,5-dioxo-N-{3-[(prop-2-en-1-yl)oxy]phenyl}-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
Chemical Structure Depiction of
6-ethyl-5,5-dioxo-N-{3-[(prop-2-en-1-yl)oxy]phenyl}-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
6-ethyl-5,5-dioxo-N-{3-[(prop-2-en-1-yl)oxy]phenyl}-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
Compound characteristics
| Compound ID: | J097-0358 |
| Compound Name: | 6-ethyl-5,5-dioxo-N-{3-[(prop-2-en-1-yl)oxy]phenyl}-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide |
| Molecular Weight: | 434.51 |
| Molecular Formula: | C24 H22 N2 O4 S |
| Smiles: | CCN1c2ccc(cc2c2ccccc2S1(=O)=O)C(Nc1cccc(c1)OCC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6112 |
| logD: | 4.611 |
| logSw: | -4.3312 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.267 |
| InChI Key: | RTSQQMFMKXNVPT-UHFFFAOYSA-N |