10-ethyl-5,11-dioxo-N-[(pyridin-3-yl)methyl]-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
10-ethyl-5,11-dioxo-N-[(pyridin-3-yl)methyl]-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
10-ethyl-5,11-dioxo-N-[(pyridin-3-yl)methyl]-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C529-1893 |
| Compound Name: | 10-ethyl-5,11-dioxo-N-[(pyridin-3-yl)methyl]-10,11-dihydro-5H-5lambda~4~-dibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 405.47 |
| Molecular Formula: | C22 H19 N3 O3 S |
| Smiles: | CCN1C(c2ccccc2S(c2ccc(cc12)C(NCc1cccnc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5753 |
| logD: | 1.5752 |
| logSw: | -2.3472 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.712 |
| InChI Key: | FJZHTUOUZMWGMY-UHFFFAOYSA-N |