N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-4-methyl-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-4-methyl-N-(propan-2-yl)benzamide
N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-4-methyl-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | V015-5355 |
| Compound Name: | N-(2-{[(2H-1,3-benzodioxol-5-yl)methyl][(3-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-4-methyl-N-(propan-2-yl)benzamide |
| Molecular Weight: | 478.61 |
| Molecular Formula: | C27 H30 N2 O4 S |
| Smiles: | CC(C)N(CC(N(Cc1ccc2c(c1)OCO2)Cc1c(C)ccs1)=O)C(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.067 |
| logD: | 5.067 |
| logSw: | -4.7625 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.011 |
| InChI Key: | QUDXOYUIRURNSN-UHFFFAOYSA-N |