3-[(2,5-dimethylphenyl)methyl]-8-(3-methylthiophene-2-carbonyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
Chemical Structure Depiction of
3-[(2,5-dimethylphenyl)methyl]-8-(3-methylthiophene-2-carbonyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
3-[(2,5-dimethylphenyl)methyl]-8-(3-methylthiophene-2-carbonyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
Compound characteristics
| Compound ID: | S395-0770 |
| Compound Name: | 3-[(2,5-dimethylphenyl)methyl]-8-(3-methylthiophene-2-carbonyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione |
| Molecular Weight: | 411.52 |
| Molecular Formula: | C22 H25 N3 O3 S |
| Smiles: | Cc1ccc(C)c(CN2C(C3(CCN(CC3)C(c3c(C)ccs3)=O)NC2=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.797 |
| logD: | 3.797 |
| logSw: | -3.7162 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.312 |
| InChI Key: | FESJZJBYPHDZJF-UHFFFAOYSA-N |