N-(2,3-dimethylphenyl)-4-(4-methylphenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-4-(4-methylphenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
N-(2,3-dimethylphenyl)-4-(4-methylphenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide
Compound characteristics
| Compound ID: | V017-0137 |
| Compound Name: | N-(2,3-dimethylphenyl)-4-(4-methylphenyl)-3-oxo-1-thia-4,8-diazaspiro[4.5]decane-8-carboxamide |
| Molecular Weight: | 409.55 |
| Molecular Formula: | C23 H27 N3 O2 S |
| Smiles: | Cc1ccc(cc1)N1C(CSC12CCN(CC2)C(Nc1cccc(C)c1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3887 |
| logD: | 4.3887 |
| logSw: | -4.0703 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.691 |
| InChI Key: | KZJFUBVPOYTMQU-UHFFFAOYSA-N |