6-{4-[2-(3-chlorophenoxy)propanoyl]piperazine-1-sulfonyl}-3-ethyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[2-(3-chlorophenoxy)propanoyl]piperazine-1-sulfonyl}-3-ethyl-1,3-benzoxazol-2(3H)-one
6-{4-[2-(3-chlorophenoxy)propanoyl]piperazine-1-sulfonyl}-3-ethyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L694-0252 |
| Compound Name: | 6-{4-[2-(3-chlorophenoxy)propanoyl]piperazine-1-sulfonyl}-3-ethyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 493.97 |
| Molecular Formula: | C22 H24 Cl N3 O6 S |
| Smiles: | CCN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(C(C)Oc1cccc(c1)[Cl])=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1702 |
| logD: | 3.1702 |
| logSw: | -3.5962 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.02 |
| InChI Key: | DAIYWYWSXHQRHG-HNNXBMFYSA-N |