3-ethyl-6-[4-(2-fluorobenzoyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-ethyl-6-[4-(2-fluorobenzoyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
3-ethyl-6-[4-(2-fluorobenzoyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one
Compound characteristics
Compound ID: | L694-0285 |
Compound Name: | 3-ethyl-6-[4-(2-fluorobenzoyl)piperazine-1-sulfonyl]-1,3-benzoxazol-2(3H)-one |
Molecular Weight: | 433.46 |
Molecular Formula: | C20 H20 F N3 O5 S |
Smiles: | CCN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(c1ccccc1F)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.1354 |
logD: | 2.1354 |
logSw: | -3.0519 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 71.23 |
InChI Key: | FTQKYCOWWGELJC-UHFFFAOYSA-N |