4-(4-methyl-1,1-dioxo-5-phenyl-1H-1lambda~6~,2-thiazol-3-yl)-N-(2-methylphenyl)-1,4-diazepane-1-carboxamide
Chemical Structure Depiction of
4-(4-methyl-1,1-dioxo-5-phenyl-1H-1lambda~6~,2-thiazol-3-yl)-N-(2-methylphenyl)-1,4-diazepane-1-carboxamide
4-(4-methyl-1,1-dioxo-5-phenyl-1H-1lambda~6~,2-thiazol-3-yl)-N-(2-methylphenyl)-1,4-diazepane-1-carboxamide
Compound characteristics
| Compound ID: | T379-0031 |
| Compound Name: | 4-(4-methyl-1,1-dioxo-5-phenyl-1H-1lambda~6~,2-thiazol-3-yl)-N-(2-methylphenyl)-1,4-diazepane-1-carboxamide |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C23 H26 N4 O3 S |
| Smiles: | CC1=C(c2ccccc2)S(N=C1N1CCCN(CC1)C(Nc1ccccc1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4467 |
| logD: | 3.4467 |
| logSw: | -3.5981 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.04 |
| InChI Key: | HBCNHEZFCPADSL-UHFFFAOYSA-N |