8-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
8-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | G610-0415 |
| Compound Name: | 8-[(2-chloro-4-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 399.89 |
| Molecular Formula: | C22 H23 Cl F N3 O |
| Smiles: | Cc1ccc(cc1C)C1C(NC2(CCN(CC2)Cc2ccc(cc2[Cl])F)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7091 |
| logD: | 4.0316 |
| logSw: | -4.8258 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.322 |
| InChI Key: | UJWOBKYMLJNPPQ-UHFFFAOYSA-N |