N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N~2~-[(3-fluorophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N~2~-[(3-fluorophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]glycinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N~2~-[(3-fluorophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]glycinamide
Compound characteristics
| Compound ID: | V027-5132 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-butyl-N~2~-[(3-fluorophenyl)carbamoyl]-N-[(3-methylthiophen-2-yl)methyl]glycinamide |
| Molecular Weight: | 511.62 |
| Molecular Formula: | C27 H30 F N3 O4 S |
| Smiles: | CCCCN(CC(N(Cc1ccc2c(c1)OCO2)Cc1c(C)ccs1)=O)C(Nc1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5237 |
| logD: | 5.5237 |
| logSw: | -5.3284 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.066 |
| InChI Key: | CDPPXHFMYOGMIY-UHFFFAOYSA-N |