N-[4-butyl-3-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-[4-butyl-3-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]thiophene-2-carboxamide
N-[4-butyl-3-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V026-0391 |
| Compound Name: | N-[4-butyl-3-(2-methylpropyl)-1,1-dioxo-1,4-dihydro-1lambda~6~,2,4-benzothiadiazin-7-yl]thiophene-2-carboxamide |
| Molecular Weight: | 419.56 |
| Molecular Formula: | C20 H25 N3 O3 S2 |
| Salt: | not_available |
| Smiles: | CCCCN1C(CC(C)C)=NS(c2cc(ccc12)NC(c1cccs1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7354 |
| logD: | 4.7345 |
| logSw: | -4.328 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.779 |
| InChI Key: | OORDOXFQPIQICA-UHFFFAOYSA-N |