3-(4-benzylpiperazin-1-yl)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Chemical Structure Depiction of
3-(4-benzylpiperazin-1-yl)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
3-(4-benzylpiperazin-1-yl)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Compound characteristics
| Compound ID: | J030-0716 |
| Compound Name: | 3-(4-benzylpiperazin-1-yl)-N-ethyl-N-methyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide |
| Molecular Weight: | 506.62 |
| Molecular Formula: | C27 H30 N4 O4 S |
| Smiles: | CCN(C)S(c1cc2C(Nc3ccccc3Oc2cc1N1CCN(CC1)Cc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2795 |
| logD: | 4.1557 |
| logSw: | -4.1797 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.593 |
| InChI Key: | SEFJZSXMPYNRGI-UHFFFAOYSA-N |