3-propyl-6-[4-(pyridine-4-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-propyl-6-[4-(pyridine-4-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
3-propyl-6-[4-(pyridine-4-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0729 |
| Compound Name: | 3-propyl-6-[4-(pyridine-4-carbonyl)piperazine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C20 H22 N4 O4 S2 |
| Smiles: | CCCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(c1ccncc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2112 |
| logD: | 2.2088 |
| logSw: | -2.4286 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 73.657 |
| InChI Key: | BXEOAMLIHLPYDI-UHFFFAOYSA-N |