N-[4-butyl-3-(3-methylphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[4-butyl-3-(3-methylphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-4-(trifluoromethyl)benzamide
N-[4-butyl-3-(3-methylphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V030-3725 |
| Compound Name: | N-[4-butyl-3-(3-methylphenyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 515.55 |
| Molecular Formula: | C26 H24 F3 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCCCN1C(c2cccc(C)c2)=NS(c2cc(ccc12)NC(c1ccc(cc1)C(F)(F)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3272 |
| logD: | 6.3191 |
| logSw: | -5.4165 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.633 |
| InChI Key: | AQVXQPXWBQGCDQ-UHFFFAOYSA-N |