N-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
N-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide
Compound characteristics
| Compound ID: | C697-1011 |
| Compound Name: | N-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-3-methyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonamide |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C22 H26 N4 O5 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(NCCC(N1CCN(CC1)Cc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2517 |
| logD: | 1.2187 |
| logSw: | -2.5237 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.637 |
| InChI Key: | HNKCUUHUMVLQBI-UHFFFAOYSA-N |