N-(2-hydroxyethyl)-4-({[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzamide
Chemical Structure Depiction of
N-(2-hydroxyethyl)-4-({[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzamide
N-(2-hydroxyethyl)-4-({[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzamide
Compound characteristics
| Compound ID: | 3334-5650 |
| Compound Name: | N-(2-hydroxyethyl)-4-({[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzamide |
| Molecular Weight: | 455.6 |
| Molecular Formula: | C23 H25 N3 O3 S2 |
| Smiles: | C=CCN1C(=Nc2c(C1=O)c1CCCCc1s2)SCc1ccc(cc1)C(NCCO)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9886 |
| logD: | 2.9886 |
| logSw: | -3.399 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.026 |
| InChI Key: | MAMZGGGCNXRZDQ-UHFFFAOYSA-N |