N-[(4-fluorophenyl)methyl]-6-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}hexanamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-6-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}hexanamide
N-[(4-fluorophenyl)methyl]-6-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}hexanamide
Compound characteristics
| Compound ID: | C241-1990 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-6-{1-[(4-methylphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}hexanamide |
| Molecular Weight: | 493.6 |
| Molecular Formula: | C27 H28 F N3 O3 S |
| Smiles: | Cc1ccc(CN2C(N(CCCCCC(NCc3ccc(cc3)F)=O)C(c3c2ccs3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0197 |
| logD: | 5.0196 |
| logSw: | -4.428 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.735 |
| InChI Key: | KMSUHOOPQJGYMF-UHFFFAOYSA-N |