ethyl 2-({[3-(butanoyloxy)-2-hydroxypropyl](3-methoxypropyl)amino}methyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-({[3-(butanoyloxy)-2-hydroxypropyl](3-methoxypropyl)amino}methyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
ethyl 2-({[3-(butanoyloxy)-2-hydroxypropyl](3-methoxypropyl)amino}methyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V022-3207 |
| Compound Name: | ethyl 2-({[3-(butanoyloxy)-2-hydroxypropyl](3-methoxypropyl)amino}methyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 483.58 |
| Molecular Formula: | C22 H33 N3 O7 S |
| Salt: | not_available |
| Smiles: | CCCC(=O)OCC(CN(CCCOC)CC1NC(c2c(C)c(C(=O)OCC)sc2N=1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1468 |
| logD: | 2.1449 |
| logSw: | -2.6067 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 105.286 |
| InChI Key: | IPYMYROZLRRWPW-HNNXBMFYSA-N |