4-({1-[(5-formyl-2-methoxyphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-propylcyclohexane-1-carboxamide
Chemical Structure Depiction of
4-({1-[(5-formyl-2-methoxyphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-propylcyclohexane-1-carboxamide
4-({1-[(5-formyl-2-methoxyphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-propylcyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G346-0266 |
| Compound Name: | 4-({1-[(5-formyl-2-methoxyphenyl)methyl]-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl}methyl)-N-propylcyclohexane-1-carboxamide |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C26 H31 N3 O5 S |
| Smiles: | CCCNC(C1CCC(CC1)CN1C(c2c(ccs2)N(Cc2cc(C=O)ccc2OC)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2577 |
| logD: | 4.2577 |
| logSw: | -4.3193 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.793 |
| InChI Key: | VVGQMHLGEJKCEI-UHFFFAOYSA-N |