4-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-phenyl-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-phenyl-1,4-diazepane-1-carboxamide
4-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-phenyl-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | T379-0033 |
| Compound Name: | 4-[4-methyl-5-(4-methylphenyl)-1,1-dioxo-1H-1lambda~6~,2-thiazol-3-yl]-N-phenyl-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Smiles: | CC1=C(c2ccc(C)cc2)S(N=C1N1CCCN(CC1)C(Nc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5925 |
| logD: | 3.5925 |
| logSw: | -3.7323 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.738 |
| InChI Key: | VXGBCVIWGQFRLA-UHFFFAOYSA-N |