3-ethyl-6-[4-(phenoxyacetyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-ethyl-6-[4-(phenoxyacetyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
3-ethyl-6-[4-(phenoxyacetyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L694-0279 |
| Compound Name: | 3-ethyl-6-[4-(phenoxyacetyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 445.49 |
| Molecular Formula: | C21 H23 N3 O6 S |
| Smiles: | CCN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(COc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7525 |
| logD: | 1.7525 |
| logSw: | -2.5924 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.202 |
| InChI Key: | ZGTSSBSPYWCMFT-UHFFFAOYSA-N |