N-butyl-N-ethyl-2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
Chemical Structure Depiction of
N-butyl-N-ethyl-2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
N-butyl-N-ethyl-2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}acetamide
Compound characteristics
| Compound ID: | C096-0088 |
| Compound Name: | N-butyl-N-ethyl-2-{5-[4-(2-methoxyphenyl)piperazine-1-sulfonyl]-6-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl}acetamide |
| Molecular Weight: | 561.72 |
| Molecular Formula: | C26 H35 N5 O5 S2 |
| Smiles: | CCCCN(CC)C(CN1C=Nc2c(C1=O)c(c(C)s2)S(N1CCN(CC1)c1ccccc1OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7486 |
| logD: | 2.7486 |
| logSw: | -3.363 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.472 |
| InChI Key: | JLDHDMCQMULFAJ-UHFFFAOYSA-N |