7-(2H-1,3-benzodioxole-5-carbonyl)-3-[(4-chlorophenyl)methyl]-1,3,7-triazaspiro[4.5]decane-2,4-dione
Chemical Structure Depiction of
7-(2H-1,3-benzodioxole-5-carbonyl)-3-[(4-chlorophenyl)methyl]-1,3,7-triazaspiro[4.5]decane-2,4-dione
7-(2H-1,3-benzodioxole-5-carbonyl)-3-[(4-chlorophenyl)methyl]-1,3,7-triazaspiro[4.5]decane-2,4-dione
Compound characteristics
| Compound ID: | S381-0095 |
| Compound Name: | 7-(2H-1,3-benzodioxole-5-carbonyl)-3-[(4-chlorophenyl)methyl]-1,3,7-triazaspiro[4.5]decane-2,4-dione |
| Molecular Weight: | 441.87 |
| Molecular Formula: | C22 H20 Cl N3 O5 |
| Smiles: | C1CC2(CN(C1)C(c1ccc3c(c1)OCO3)=O)C(N(Cc1ccc(cc1)[Cl])C(N2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.74 |
| logD: | 2.7398 |
| logSw: | -3.653 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.342 |
| InChI Key: | CEFMIIVSUFCCHP-QFIPXVFZSA-N |