4-(3-chloro-4-fluorophenyl)-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Chemical Structure Depiction of
4-(3-chloro-4-fluorophenyl)-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
4-(3-chloro-4-fluorophenyl)-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione
Compound characteristics
| Compound ID: | L810-0046 |
| Compound Name: | 4-(3-chloro-4-fluorophenyl)-2-(pyrrolidine-1-carbonyl)-1lambda~6~,4-benzothiazine-1,1(4H)-dione |
| Molecular Weight: | 406.86 |
| Molecular Formula: | C19 H16 Cl F N2 O3 S |
| Smiles: | C1CCN(C1)C(C1=CN(c2ccc(c(c2)[Cl])F)c2ccccc2S1(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7412 |
| logD: | 2.7412 |
| logSw: | -3.3543 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.965 |
| InChI Key: | XHPKTMKQFAQPOD-UHFFFAOYSA-N |