N-(2-methoxy-6-nitrophenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-6-nitrophenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
N-(2-methoxy-6-nitrophenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C791-0041 |
| Compound Name: | N-(2-methoxy-6-nitrophenyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 421.43 |
| Molecular Formula: | C21 H15 N3 O5 S |
| Smiles: | COc1cccc(c1NC(c1ccc2c(c1)NC(c1ccccc1S2)=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6323 |
| logD: | 2.1972 |
| logSw: | -4.1182 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.582 |
| InChI Key: | FNLFMYUEDOGONY-UHFFFAOYSA-N |