6-{4-[4-(dimethylamino)benzoyl]piperazine-1-sulfonyl}-3-ethyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[4-(dimethylamino)benzoyl]piperazine-1-sulfonyl}-3-ethyl-1,3-benzoxazol-2(3H)-one
6-{4-[4-(dimethylamino)benzoyl]piperazine-1-sulfonyl}-3-ethyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L694-0207 |
| Compound Name: | 6-{4-[4-(dimethylamino)benzoyl]piperazine-1-sulfonyl}-3-ethyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C22 H26 N4 O5 S |
| Smiles: | CCN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(c1ccc(cc1)N(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0898 |
| logD: | 2.0898 |
| logSw: | -3.0177 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.035 |
| InChI Key: | PFGYRJMTAYPAER-UHFFFAOYSA-N |