3-ethyl-6-{4-[4-(trifluoromethyl)benzoyl]piperazine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-ethyl-6-{4-[4-(trifluoromethyl)benzoyl]piperazine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
3-ethyl-6-{4-[4-(trifluoromethyl)benzoyl]piperazine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L694-0295 |
| Compound Name: | 3-ethyl-6-{4-[4-(trifluoromethyl)benzoyl]piperazine-1-sulfonyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 483.46 |
| Molecular Formula: | C21 H20 F3 N3 O5 S |
| Smiles: | CCN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8726 |
| logD: | 2.8726 |
| logSw: | -3.4965 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 71.23 |
| InChI Key: | CMBFEVCKOUOCOP-UHFFFAOYSA-N |