6-chloro-7-[4-(4-fluorobenzoyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-chloro-7-[4-(4-fluorobenzoyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
6-chloro-7-[4-(4-fluorobenzoyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F536-0224 |
| Compound Name: | 6-chloro-7-[4-(4-fluorobenzoyl)piperazine-1-sulfonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 453.87 |
| Molecular Formula: | C19 H17 Cl F N3 O5 S |
| Smiles: | C1CN(CCN1C(c1ccc(cc1)F)=O)S(c1cc2c(cc1[Cl])NC(CO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4816 |
| logD: | 1.423 |
| logSw: | -2.9511 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.676 |
| InChI Key: | AXMLPWMTECOSKU-UHFFFAOYSA-N |