4-[5-(4-chlorophenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-methyl-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[5-(4-chlorophenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-methyl-1,4-diazepane-1-carboxamide
4-[5-(4-chlorophenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-methyl-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | T379-0087 |
| Compound Name: | 4-[5-(4-chlorophenyl)-4-methyl-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-methyl-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 396.89 |
| Molecular Formula: | C17 H21 Cl N4 O3 S |
| Smiles: | CC1=C(c2ccc(cc2)[Cl])S(N=C1N1CCCN(CC1)C(NC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3428 |
| logD: | 2.3428 |
| logSw: | -3.4336 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.482 |
| InChI Key: | RFTQDZQRPLJFIC-UHFFFAOYSA-N |