3-(azepane-1-carbonyl)-2-methyl-5-(thiophen-2-yl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-(azepane-1-carbonyl)-2-methyl-5-(thiophen-2-yl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
3-(azepane-1-carbonyl)-2-methyl-5-(thiophen-2-yl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E135-1144 |
| Compound Name: | 3-(azepane-1-carbonyl)-2-methyl-5-(thiophen-2-yl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione |
| Molecular Weight: | 353.46 |
| Molecular Formula: | C15 H19 N3 O3 S2 |
| Smiles: | CN1C(=CC(c2cccs2)=NS1(=O)=O)C(N1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4547 |
| logD: | 2.4547 |
| logSw: | -2.4877 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.225 |
| InChI Key: | YQWRRQPFNMMDSM-UHFFFAOYSA-N |