N-(4-chloro-2,5-dimethoxyphenyl)-5,5-dioxo-6-(prop-2-en-1-yl)-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
Chemical Structure Depiction of
N-(4-chloro-2,5-dimethoxyphenyl)-5,5-dioxo-6-(prop-2-en-1-yl)-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
N-(4-chloro-2,5-dimethoxyphenyl)-5,5-dioxo-6-(prop-2-en-1-yl)-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
Compound characteristics
| Compound ID: | J097-0539 |
| Compound Name: | N-(4-chloro-2,5-dimethoxyphenyl)-5,5-dioxo-6-(prop-2-en-1-yl)-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide |
| Molecular Weight: | 484.96 |
| Molecular Formula: | C24 H21 Cl N2 O5 S |
| Smiles: | COc1cc(c(cc1NC(c1ccc2c(c1)c1ccccc1S(N2CC=C)(=O)=O)=O)OC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7381 |
| logD: | 4.3742 |
| logSw: | -4.8726 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.666 |
| InChI Key: | JPQXGFVABVOWKL-UHFFFAOYSA-N |