N-butyl-2-methyl-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Chemical Structure Depiction of
N-butyl-2-methyl-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
N-butyl-2-methyl-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide
Compound characteristics
| Compound ID: | E135-1159 |
| Compound Name: | N-butyl-2-methyl-1,1-dioxo-5-(thiophen-2-yl)-1,2-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxamide |
| Molecular Weight: | 327.42 |
| Molecular Formula: | C13 H17 N3 O3 S2 |
| Smiles: | CCCCNC(C1=CC(c2cccs2)=NS(N1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1845 |
| logD: | 2.1841 |
| logSw: | -2.8166 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.772 |
| InChI Key: | PTSMBRMUNWUPJY-UHFFFAOYSA-N |