6-[4-(1-ethyl-1H-pyrazole-3-carbonyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(1-ethyl-1H-pyrazole-3-carbonyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one
6-[4-(1-ethyl-1H-pyrazole-3-carbonyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L475-0755 |
| Compound Name: | 6-[4-(1-ethyl-1H-pyrazole-3-carbonyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 463.58 |
| Molecular Formula: | C20 H25 N5 O4 S2 |
| Smiles: | CCCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)C(c1ccn(CC)n1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3949 |
| logD: | 2.3949 |
| logSw: | -2.7219 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 78.613 |
| InChI Key: | XYNURIAMVABAAJ-UHFFFAOYSA-N |