2-{[(3-tert-butoxy-2-hydroxypropyl)(3-methylbutyl)amino]methyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(3-tert-butoxy-2-hydroxypropyl)(3-methylbutyl)amino]methyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-{[(3-tert-butoxy-2-hydroxypropyl)(3-methylbutyl)amino]methyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V021-3266 |
| Compound Name: | 2-{[(3-tert-butoxy-2-hydroxypropyl)(3-methylbutyl)amino]methyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 435.63 |
| Molecular Formula: | C23 H37 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)CCN(CC(COC(C)(C)C)O)CC1NC(c2c3CCCCc3sc2N=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4139 |
| logD: | 4.4127 |
| logSw: | -4.1631 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.289 |
| InChI Key: | QITLUEQXEBUKOT-INIZCTEOSA-N |