N-butyl-4-({1-[(2-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide
Chemical Structure Depiction of
N-butyl-4-({1-[(2-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide
N-butyl-4-({1-[(2-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G346-0506 |
| Compound Name: | N-butyl-4-({1-[(2-fluorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-methylcyclohexane-1-carboxamide |
| Molecular Weight: | 485.62 |
| Molecular Formula: | C26 H32 F N3 O3 S |
| Smiles: | CCCCN(C)C(C1CCC(CC1)CN1C(c2c(ccs2)N(Cc2ccccc2F)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.577 |
| logD: | 5.577 |
| logSw: | -5.3239 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.878 |
| InChI Key: | GQPVAZMMJKDXLZ-UHFFFAOYSA-N |