N-[4-(2-oxo-2-{4-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzothiazole-6-sulfonyl]piperazin-1-yl}ethyl)phenyl]acetamide
Chemical Structure Depiction of
N-[4-(2-oxo-2-{4-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzothiazole-6-sulfonyl]piperazin-1-yl}ethyl)phenyl]acetamide
N-[4-(2-oxo-2-{4-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzothiazole-6-sulfonyl]piperazin-1-yl}ethyl)phenyl]acetamide
Compound characteristics
| Compound ID: | L475-0784 |
| Compound Name: | N-[4-(2-oxo-2-{4-[2-oxo-3-(propan-2-yl)-2,3-dihydro-1,3-benzothiazole-6-sulfonyl]piperazin-1-yl}ethyl)phenyl]acetamide |
| Molecular Weight: | 516.64 |
| Molecular Formula: | C24 H28 N4 O5 S2 |
| Smiles: | CC(C)N1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(Cc1ccc(cc1)NC(C)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8786 |
| logD: | 2.8786 |
| logSw: | -3.5578 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.705 |
| InChI Key: | MYSGHGXQCBMSBI-UHFFFAOYSA-N |