6-[4-(6-chloropyridine-3-carbonyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(6-chloropyridine-3-carbonyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzothiazol-2(3H)-one
6-[4-(6-chloropyridine-3-carbonyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0885 |
| Compound Name: | 6-[4-(6-chloropyridine-3-carbonyl)piperazine-1-sulfonyl]-3-(propan-2-yl)-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 480.99 |
| Molecular Formula: | C20 H21 Cl N4 O4 S2 |
| Smiles: | CC(C)N1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(c1ccc(nc1)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8906 |
| logD: | 2.8906 |
| logSw: | -3.4541 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 72.975 |
| InChI Key: | XCZJVDTZJPBFLL-UHFFFAOYSA-N |