3-(2H-1,3-benzodioxole-5-carbonyl)-9-benzyl-3,9-diazaspiro[5.6]dodecan-10-one
Chemical Structure Depiction of
3-(2H-1,3-benzodioxole-5-carbonyl)-9-benzyl-3,9-diazaspiro[5.6]dodecan-10-one
3-(2H-1,3-benzodioxole-5-carbonyl)-9-benzyl-3,9-diazaspiro[5.6]dodecan-10-one
Compound characteristics
| Compound ID: | S509-1897 |
| Compound Name: | 3-(2H-1,3-benzodioxole-5-carbonyl)-9-benzyl-3,9-diazaspiro[5.6]dodecan-10-one |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C25 H28 N2 O4 |
| Smiles: | C1CC2(CCN(Cc3ccccc3)C1=O)CCN(CC2)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4936 |
| logD: | 2.4936 |
| logSw: | -2.92 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.958 |
| InChI Key: | MRBULMAJKWGFEJ-UHFFFAOYSA-N |