N-ethyl-3-[4-(4-fluorophenyl)piperazin-1-yl]-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Chemical Structure Depiction of
N-ethyl-3-[4-(4-fluorophenyl)piperazin-1-yl]-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
N-ethyl-3-[4-(4-fluorophenyl)piperazin-1-yl]-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Compound characteristics
| Compound ID: | J030-0683 |
| Compound Name: | N-ethyl-3-[4-(4-fluorophenyl)piperazin-1-yl]-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide |
| Molecular Weight: | 510.59 |
| Molecular Formula: | C26 H27 F N4 O4 S |
| Smiles: | CCN(C)S(c1cc2C(Nc3ccccc3Oc2cc1N1CCN(CC1)c1ccc(cc1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7491 |
| logD: | 4.6808 |
| logSw: | -4.3858 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.313 |
| InChI Key: | UIKIQRPPMKXGNS-UHFFFAOYSA-N |