3-benzyl-8-(3-methoxybenzoyl)-1-(2-methylbutyl)-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
3-benzyl-8-(3-methoxybenzoyl)-1-(2-methylbutyl)-1,4,8-triazaspiro[4.5]decan-2-one
3-benzyl-8-(3-methoxybenzoyl)-1-(2-methylbutyl)-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V018-9669 |
| Compound Name: | 3-benzyl-8-(3-methoxybenzoyl)-1-(2-methylbutyl)-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 449.59 |
| Molecular Formula: | C27 H35 N3 O3 |
| Smiles: | CCC(C)CN1C(C(Cc2ccccc2)NC12CCN(CC2)C(c1cccc(c1)OC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8414 |
| logD: | 2.1618 |
| logSw: | -4.0884 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.864 |
| InChI Key: | LMJYTIOXZYCGTN-UHFFFAOYSA-N |