8-(3-chloro-2,2-dimethylpropanoyl)-4-(3-methylphenyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one
Chemical Structure Depiction of
8-(3-chloro-2,2-dimethylpropanoyl)-4-(3-methylphenyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one
8-(3-chloro-2,2-dimethylpropanoyl)-4-(3-methylphenyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one
Compound characteristics
| Compound ID: | V013-1642 |
| Compound Name: | 8-(3-chloro-2,2-dimethylpropanoyl)-4-(3-methylphenyl)-1-thia-4,8-diazaspiro[4.5]decan-3-one |
| Molecular Weight: | 380.94 |
| Molecular Formula: | C19 H25 Cl N2 O2 S |
| Smiles: | Cc1cccc(c1)N1C(CSC12CCN(CC2)C(C(C)(C)C[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4613 |
| logD: | 3.4613 |
| logSw: | -3.5951 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.839 |
| InChI Key: | FTNNTSQQEQBHJW-UHFFFAOYSA-N |