N-[(4-chlorophenyl)methyl]-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-chlorophenyl)methyl]-5,5-dioxo-6-(prop-2-en-1-yl)-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide
N-[(4-chlorophenyl)methyl]-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: | J097-0457 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-5,5-dioxo-6-(prop-2-en-1-yl)-5,6-dihydro-5lambda~6~-dibenzo[c,e][1,2]thiazine-9-carboxamide |
| Molecular Weight: | 438.93 |
| Molecular Formula: | C23 H19 Cl N2 O3 S |
| Smiles: | C=CCN1c2ccc(cc2c2ccccc2S1(=O)=O)C(NCc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5117 |
| logD: | 4.5117 |
| logSw: | -4.7539 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.425 |
| InChI Key: | BAQMCSBBYIQALR-UHFFFAOYSA-N |