N-(4-butyl-3-cyclopentyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-(4-butyl-3-cyclopentyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)-4-(trifluoromethyl)benzamide
N-(4-butyl-3-cyclopentyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | V025-9449 |
| Compound Name: | N-(4-butyl-3-cyclopentyl-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl)-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 493.55 |
| Molecular Formula: | C24 H26 F3 N3 O3 S |
| Salt: | not_available |
| Smiles: | CCCCN1C(C2CCCC2)=NS(c2cc(ccc12)NC(c1ccc(cc1)C(F)(F)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.027 |
| logD: | 6.019 |
| logSw: | -5.4064 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.191 |
| InChI Key: | VCGWJRRYKQMXMN-UHFFFAOYSA-N |