6-{4-[(4-methoxyphenoxy)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[(4-methoxyphenoxy)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
6-{4-[(4-methoxyphenoxy)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | L694-0137 |
| Compound Name: | 6-{4-[(4-methoxyphenoxy)acetyl]piperazine-1-sulfonyl}-3-methyl-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 461.49 |
| Molecular Formula: | C21 H23 N3 O7 S |
| Smiles: | CN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C(COc1ccc(cc1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.262 |
| logD: | 1.262 |
| logSw: | -2.4516 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 85.787 |
| InChI Key: | DGQMMNKZZHZLBJ-UHFFFAOYSA-N |