N-[(5-bromo-2-methoxyphenyl)methyl]-N~2~-{1-[(4-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane-4-carbothioyl}glycinamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-N~2~-{1-[(4-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane-4-carbothioyl}glycinamide
N-[(5-bromo-2-methoxyphenyl)methyl]-N~2~-{1-[(4-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane-4-carbothioyl}glycinamide
Compound characteristics
| Compound ID: | K786-6485 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-N~2~-{1-[(4-methylphenyl)methyl]-1,4-diazaspiro[5.5]undecane-4-carbothioyl}glycinamide |
| Molecular Weight: | 573.6 |
| Molecular Formula: | C28 H37 Br N4 O2 S |
| Smiles: | Cc1ccc(CN2CCN(CC23CCCCC3)C(NCC(NCc2cc(ccc2OC)[Br])=O)=S)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.8772 |
| logD: | 4.5267 |
| logSw: | -5.2895 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.601 |
| InChI Key: | RZBUPTWPKACLIJ-UHFFFAOYSA-N |