2-{[(3-ethoxy-2-hydroxypropyl)(2-methylpropyl)amino]methyl}-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-ethoxy-2-hydroxypropyl)(2-methylpropyl)amino]methyl}-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
2-{[(3-ethoxy-2-hydroxypropyl)(2-methylpropyl)amino]methyl}-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V012-2776 |
| Compound Name: | 2-{[(3-ethoxy-2-hydroxypropyl)(2-methylpropyl)amino]methyl}-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 429.58 |
| Molecular Formula: | C23 H31 N3 O3 S |
| Smiles: | CCOCC(CN(CC(C)C)CC1NC(c2c(csc2N=1)c1ccc(C)cc1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8845 |
| logD: | 3.8835 |
| logSw: | -4.2672 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.464 |
| InChI Key: | KATHWQZZZYMWCO-SFHVURJKSA-N |