N-[(4-methylphenyl)methyl]-1,3-dioxo-4-phenyl-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-1,3-dioxo-4-phenyl-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
N-[(4-methylphenyl)methyl]-1,3-dioxo-4-phenyl-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
Compound characteristics
| Compound ID: | S588-0764 |
| Compound Name: | N-[(4-methylphenyl)methyl]-1,3-dioxo-4-phenyl-1lambda~4~-thia-4,8-diazaspiro[4.5]decane-8-carboxamide |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | Cc1ccc(CNC(N2CCC3(CC2)N(C(CS3=O)=O)c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.8981 |
| logD: | 1.8981 |
| logSw: | -2.3669 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.841 |
| InChI Key: | HWIDBDZSDGKUCX-UHFFFAOYSA-N |