6-{4-[(3-methylphenoxy)acetyl]piperazine-1-sulfonyl}-3-propyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[(3-methylphenoxy)acetyl]piperazine-1-sulfonyl}-3-propyl-1,3-benzothiazol-2(3H)-one
6-{4-[(3-methylphenoxy)acetyl]piperazine-1-sulfonyl}-3-propyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0730 |
| Compound Name: | 6-{4-[(3-methylphenoxy)acetyl]piperazine-1-sulfonyl}-3-propyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 489.61 |
| Molecular Formula: | C23 H27 N3 O5 S2 |
| Smiles: | CCCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(COc1cccc(C)c1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7327 |
| logD: | 3.7327 |
| logSw: | -3.928 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 71.2 |
| InChI Key: | ANDOHNNJBPUGTQ-UHFFFAOYSA-N |