N-[4-butyl-3-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[4-butyl-3-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-4-methoxybenzamide
N-[4-butyl-3-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | V026-0439 |
| Compound Name: | N-[4-butyl-3-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]-4-methoxybenzamide |
| Molecular Weight: | 443.56 |
| Molecular Formula: | C23 H29 N3 O4 S |
| Salt: | not_available |
| Smiles: | CCCCN1C(CC(C)C)=NS(c2cc(ccc12)NC(c1ccc(cc1)OC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8052 |
| logD: | 4.802 |
| logSw: | -4.4213 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.304 |
| InChI Key: | GBJHLFMNDFHESI-UHFFFAOYSA-N |