N-butyl-4-({1-[(2-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-butyl-4-({1-[(2-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)cyclohexane-1-carboxamide
N-butyl-4-({1-[(2-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G346-0288 |
| Compound Name: | N-butyl-4-({1-[(2-chlorophenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 488.05 |
| Molecular Formula: | C25 H30 Cl N3 O3 S |
| Smiles: | CCCCNC(C1CCC(CC1)CN1C(c2c(ccs2)N(Cc2ccccc2[Cl])C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9023 |
| logD: | 5.9023 |
| logSw: | -5.8379 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.004 |
| InChI Key: | MLPIOPIMIHXKBY-UHFFFAOYSA-N |