3-[(1-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}cyclopentyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-[(1-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}cyclopentyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
3-[(1-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}cyclopentyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | K261-0707 |
| Compound Name: | 3-[(1-{2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}cyclopentyl)methyl]-1lambda~6~,2,4-benzothiadiazine-1,1(2H)-dione |
| Molecular Weight: | 496.63 |
| Molecular Formula: | C26 H32 N4 O4 S |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(CC1(CCCC1)CC1NS(c2ccccc2N=1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0652 |
| logD: | 2.4909 |
| logSw: | -3.6938 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.107 |
| InChI Key: | KHMIBWFFNMIVRA-UHFFFAOYSA-N |