4-ethyl-3-({[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}sulfanyl)-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-ethyl-3-({[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}sulfanyl)-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
4-ethyl-3-({[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}sulfanyl)-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | C200-8598 |
| Compound Name: | 4-ethyl-3-({[4-(2-oxopyrrolidin-1-yl)phenyl]methyl}sulfanyl)-1lambda~6~,2,4-benzothiadiazine-1,1(4H)-dione |
| Molecular Weight: | 415.53 |
| Molecular Formula: | C20 H21 N3 O3 S2 |
| Smiles: | CCN1C(=NS(c2ccccc12)(=O)=O)SCc1ccc(cc1)N1CCCC1=O |
| Stereo: | ACHIRAL |
| logP: | 3.0213 |
| logD: | 3.0213 |
| logSw: | -3.5304 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.526 |
| InChI Key: | RTEULQPLJCAGOD-UHFFFAOYSA-N |