N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-3-bromo-N-(2-methylbutyl)benzamide
Chemical Structure Depiction of
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-3-bromo-N-(2-methylbutyl)benzamide
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-3-bromo-N-(2-methylbutyl)benzamide
Compound characteristics
| Compound ID: | V022-2232 |
| Compound Name: | N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-3-bromo-N-(2-methylbutyl)benzamide |
| Molecular Weight: | 571.53 |
| Molecular Formula: | C28 H31 Br N2 O4 S |
| Smiles: | CCC(C)CN(CC(N(Cc1ccc2c(c1)OCO2)Cc1c(C)ccs1)=O)C(c1cccc(c1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.226 |
| logD: | 6.226 |
| logSw: | -5.5495 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.267 |
| InChI Key: | OUQYQYQSPVTJGV-IBGZPJMESA-N |