N,N-diethyl-3-(4-methylpiperazin-1-yl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Chemical Structure Depiction of
N,N-diethyl-3-(4-methylpiperazin-1-yl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
N,N-diethyl-3-(4-methylpiperazin-1-yl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide
Compound characteristics
| Compound ID: | J030-0616 |
| Compound Name: | N,N-diethyl-3-(4-methylpiperazin-1-yl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]oxazepine-2-sulfonamide |
| Molecular Weight: | 444.55 |
| Molecular Formula: | C22 H28 N4 O4 S |
| Smiles: | CCN(CC)S(c1cc2C(Nc3ccccc3Oc2cc1N1CCN(C)CC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0779 |
| logD: | 2.7113 |
| logSw: | -3.7353 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.065 |
| InChI Key: | IFQANTKJQHNNII-UHFFFAOYSA-N |