3-(azepane-1-carbonyl)-2-methyl-5-(4-methylphenyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Chemical Structure Depiction of
3-(azepane-1-carbonyl)-2-methyl-5-(4-methylphenyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
3-(azepane-1-carbonyl)-2-methyl-5-(4-methylphenyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione
Compound characteristics
| Compound ID: | E135-0148 |
| Compound Name: | 3-(azepane-1-carbonyl)-2-methyl-5-(4-methylphenyl)-1lambda~6~,2,6-thiadiazine-1,1(2H)-dione |
| Molecular Weight: | 361.46 |
| Molecular Formula: | C18 H23 N3 O3 S |
| Smiles: | Cc1ccc(cc1)C1C=C(C(N2CCCCCC2)=O)N(C)S(N=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0589 |
| logD: | 3.0589 |
| logSw: | -3.2801 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.207 |
| InChI Key: | PHMUSPYMLFMRIB-UHFFFAOYSA-N |