2-[3-(3-methoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N,N-dipropylacetamide
Chemical Structure Depiction of
2-[3-(3-methoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N,N-dipropylacetamide
2-[3-(3-methoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N,N-dipropylacetamide
Compound characteristics
| Compound ID: | C258-0233 |
| Compound Name: | 2-[3-(3-methoxyphenyl)-2,4-dioxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-1(2H)-yl]-N,N-dipropylacetamide |
| Molecular Weight: | 469.6 |
| Molecular Formula: | C25 H31 N3 O4 S |
| Smiles: | CCCN(CCC)C(CN1C(N(C(c2c3CCCCc3sc12)=O)c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3335 |
| logD: | 4.3335 |
| logSw: | -4.4657 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.755 |
| InChI Key: | XXVSBXCBBOUVLZ-UHFFFAOYSA-N |