2-[4-(2H-1,3-benzodioxol-5-yl)-9-methyl-1,5,9-triazaspiro[5.5]undec-4-en-2-yl]-4-chlorophenol
Chemical Structure Depiction of
2-[4-(2H-1,3-benzodioxol-5-yl)-9-methyl-1,5,9-triazaspiro[5.5]undec-4-en-2-yl]-4-chlorophenol
2-[4-(2H-1,3-benzodioxol-5-yl)-9-methyl-1,5,9-triazaspiro[5.5]undec-4-en-2-yl]-4-chlorophenol
Compound characteristics
| Compound ID: | Z274-0173 |
| Compound Name: | 2-[4-(2H-1,3-benzodioxol-5-yl)-9-methyl-1,5,9-triazaspiro[5.5]undec-4-en-2-yl]-4-chlorophenol |
| Molecular Weight: | 413.9 |
| Molecular Formula: | C22 H24 Cl N3 O3 |
| Smiles: | CN1CCC2(CC1)NC(CC(c1ccc3c(c1)OCO3)=N2)c1cc(ccc1O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.544 |
| logD: | 1.3353 |
| logSw: | -3.7838 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.119 |
| InChI Key: | MKAQNJMVSVATHS-SFHVURJKSA-N |