5-(2,5-dimethylphenyl)-2-{[(2-hydroxy-3-phenoxypropyl)(2-methylpropyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(2,5-dimethylphenyl)-2-{[(2-hydroxy-3-phenoxypropyl)(2-methylpropyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
5-(2,5-dimethylphenyl)-2-{[(2-hydroxy-3-phenoxypropyl)(2-methylpropyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V018-2174 |
| Compound Name: | 5-(2,5-dimethylphenyl)-2-{[(2-hydroxy-3-phenoxypropyl)(2-methylpropyl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 491.65 |
| Molecular Formula: | C28 H33 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)CN(CC(COc1ccccc1)O)CC1NC(c2c(csc2N=1)c1cc(C)ccc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5507 |
| logD: | 5.5499 |
| logSw: | -5.4059 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.633 |
| InChI Key: | HUTLOAGOFYCAGR-NRFANRHFSA-N |