2-{[(2-hydroxy-3-phenylpropyl)(2-methylpropyl)amino]methyl}-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(2-hydroxy-3-phenylpropyl)(2-methylpropyl)amino]methyl}-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
2-{[(2-hydroxy-3-phenylpropyl)(2-methylpropyl)amino]methyl}-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V022-8613 |
| Compound Name: | 2-{[(2-hydroxy-3-phenylpropyl)(2-methylpropyl)amino]methyl}-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 477.63 |
| Molecular Formula: | C27 H31 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)CN(CC(Cc1ccccc1)O)CC1NC(c2c(csc2N=1)c1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.975 |
| logD: | 4.974 |
| logSw: | -4.5968 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.678 |
| InChI Key: | PQAVMHNMGWIILN-NRFANRHFSA-N |