N-[3-(2-fluorophenyl)-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-3-nitrobenzamide
Chemical Structure Depiction of
N-[3-(2-fluorophenyl)-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-3-nitrobenzamide
N-[3-(2-fluorophenyl)-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-3-nitrobenzamide
Compound characteristics
| Compound ID: | V007-5169 |
| Compound Name: | N-[3-(2-fluorophenyl)-1,1-dioxo-4-propyl-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-3-nitrobenzamide |
| Molecular Weight: | 482.49 |
| Molecular Formula: | C23 H19 F N4 O5 S |
| Smiles: | CCCN1C(c2ccccc2F)=NS(c2cc(ccc12)NC(c1cccc(c1)[N+]([O-])=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5024 |
| logD: | 4.4225 |
| logSw: | -4.3037 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.015 |
| InChI Key: | CTTBLJQGNUNVRG-UHFFFAOYSA-N |