3-methyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
3-methyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
3-methyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | L306-0469 |
| Compound Name: | 3-methyl-6-[4-(pyrrolidine-1-carbonyl)piperidine-1-sulfonyl]-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 409.52 |
| Molecular Formula: | C18 H23 N3 O4 S2 |
| Smiles: | CN1C(=O)Sc2cc(ccc12)S(N1CCC(CC1)C(N1CCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5203 |
| logD: | 2.5203 |
| logSw: | -2.8428 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.574 |
| InChI Key: | XCCYDEYWRHUGBC-UHFFFAOYSA-N |