N-{2-[4-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperazin-1-yl]-2-oxoethyl}-4-methylbenzamide
Chemical Structure Depiction of
N-{2-[4-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperazin-1-yl]-2-oxoethyl}-4-methylbenzamide
N-{2-[4-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperazin-1-yl]-2-oxoethyl}-4-methylbenzamide
Compound characteristics
| Compound ID: | L694-0182 |
| Compound Name: | N-{2-[4-(3-ethyl-2-oxo-2,3-dihydro-1,3-benzoxazole-6-sulfonyl)piperazin-1-yl]-2-oxoethyl}-4-methylbenzamide |
| Molecular Weight: | 486.55 |
| Molecular Formula: | C23 H26 N4 O6 S |
| Smiles: | CCN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(CNC(c1ccc(C)cc1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9279 |
| logD: | 1.9278 |
| logSw: | -2.7306 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.388 |
| InChI Key: | FVEOOHFGIUFLFS-UHFFFAOYSA-N |