4-{[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-N-(2-hydroxyethyl)benzamide
Chemical Structure Depiction of
4-{[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-N-(2-hydroxyethyl)benzamide
4-{[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-N-(2-hydroxyethyl)benzamide
Compound characteristics
Compound ID: | 4236-0429 |
Compound Name: | 4-{[(4-amino-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-N-(2-hydroxyethyl)benzamide |
Molecular Weight: | 414.55 |
Molecular Formula: | C20 H22 N4 O2 S2 |
Smiles: | C1CCc2c(C1)c1c(N)nc(nc1s2)SCc1ccc(cc1)C(NCCO)=O |
Stereo: | ACHIRAL |
logP: | 2.8495 |
logD: | 2.8493 |
logSw: | -3.5085 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 80.164 |
InChI Key: | ZCKVDBTVUTUHDM-UHFFFAOYSA-N |