5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxyhex-5-en-1-yl)(methyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxyhex-5-en-1-yl)(methyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxyhex-5-en-1-yl)(methyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V015-0479 |
| Compound Name: | 5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxyhex-5-en-1-yl)(methyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C22 H27 N3 O4 S |
| Smiles: | CN(CC(CCC=C)O)CC1NC(c2c(csc2N=1)c1ccc(c(c1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7727 |
| logD: | 2.771 |
| logSw: | -3.4318 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.799 |
| InChI Key: | SUTXJNXPNSFBHV-HNNXBMFYSA-N |