N-(3,4-dimethylphenyl)-2-{[3-phenyl-8-(propan-2-yl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-2-{[3-phenyl-8-(propan-2-yl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
N-(3,4-dimethylphenyl)-2-{[3-phenyl-8-(propan-2-yl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C916-0154 |
| Compound Name: | N-(3,4-dimethylphenyl)-2-{[3-phenyl-8-(propan-2-yl)-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 448.63 |
| Molecular Formula: | C26 H32 N4 O S |
| Smiles: | CC(C)N1CCC2(CC1)N=C(C(=N2)SCC(Nc1ccc(C)c(C)c1)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8121 |
| logD: | 1.808 |
| logSw: | -4.4043 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.094 |
| InChI Key: | JRIALBMTQJUVIC-UHFFFAOYSA-N |