4-butyl-7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-butyl-7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
4-butyl-7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | J049-1579 |
| Compound Name: | 4-butyl-7-[4-(2-fluorophenyl)piperazine-1-carbonyl]-3-methyl-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione |
| Molecular Weight: | 458.55 |
| Molecular Formula: | C23 H27 F N4 O3 S |
| Smiles: | CCCCN1C(C)=NS(c2cc(ccc12)C(N1CCN(CC1)c1ccccc1F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3098 |
| logD: | 3.3098 |
| logSw: | -3.7641 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.185 |
| InChI Key: | UOLQDHKRLPMIBP-UHFFFAOYSA-N |