6-{4-[(3-methoxyphenyl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[(3-methoxyphenyl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
6-{4-[(3-methoxyphenyl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0064 |
| Compound Name: | 6-{4-[(3-methoxyphenyl)acetyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C20 H21 N3 O5 S2 |
| Smiles: | COc1cccc(CC(N2CCN(CC2)S(c2ccc3c(c2)SC(N3)=O)(=O)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.6756 |
| logD: | 2.6539 |
| logSw: | -3.2398 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.57 |
| InChI Key: | LPGMWSNFJOIHBF-UHFFFAOYSA-N |