N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-4-(methanesulfonyl)-1,2-dimethyl-6-oxopiperazine-2-carboxamide
Chemical Structure Depiction of
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-4-(methanesulfonyl)-1,2-dimethyl-6-oxopiperazine-2-carboxamide
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-4-(methanesulfonyl)-1,2-dimethyl-6-oxopiperazine-2-carboxamide
Compound characteristics
| Compound ID: | E646-7449 |
| Compound Name: | N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-4-(methanesulfonyl)-1,2-dimethyl-6-oxopiperazine-2-carboxamide |
| Molecular Weight: | 440.47 |
| Molecular Formula: | C18 H24 N4 O7 S |
| Smiles: | CC1(CN(CC(N1C)=O)S(C)(=O)=O)C(NCC(NCc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.177 |
| logD: | -0.177 |
| logSw: | -2.4644 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 113.67 |
| InChI Key: | VFFFQUCPKLEVFJ-SFHVURJKSA-N |