2-({[2-hydroxy-3-(2-methylphenoxy)propyl](prop-2-en-1-yl)amino}methyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-({[2-hydroxy-3-(2-methylphenoxy)propyl](prop-2-en-1-yl)amino}methyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
2-({[2-hydroxy-3-(2-methylphenoxy)propyl](prop-2-en-1-yl)amino}methyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V018-0343 |
| Compound Name: | 2-({[2-hydroxy-3-(2-methylphenoxy)propyl](prop-2-en-1-yl)amino}methyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 413.54 |
| Molecular Formula: | C22 H27 N3 O3 S |
| Salt: | not_available |
| Smiles: | Cc1ccccc1OCC(CN(CC=C)CC1NC(c2c(C)c(C)sc2N=1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8692 |
| logD: | 3.8686 |
| logSw: | -4.34 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.97 |
| InChI Key: | HEKUVKYMFACJER-KRWDZBQOSA-N |