N-butyl-N-(2-{[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-2-methylpropanamide
Chemical Structure Depiction of
N-butyl-N-(2-{[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-2-methylpropanamide
N-butyl-N-(2-{[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-2-methylpropanamide
Compound characteristics
| Compound ID: | V026-2722 |
| Compound Name: | N-butyl-N-(2-{[(4-fluorophenyl)methyl][(5-methylthiophen-2-yl)methyl]amino}-2-oxoethyl)-2-methylpropanamide |
| Molecular Weight: | 418.57 |
| Molecular Formula: | C23 H31 F N2 O2 S |
| Smiles: | CCCCN(CC(N(Cc1ccc(cc1)F)Cc1ccc(C)s1)=O)C(C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.917 |
| logD: | 4.917 |
| logSw: | -4.4243 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.401 |
| InChI Key: | IUKNVAKYJLEFAX-UHFFFAOYSA-N |