2-(3-chloro-4-hydroxy-5-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-(3-chloro-4-hydroxy-5-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-(3-chloro-4-hydroxy-5-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
Compound ID: | 8014-9081 |
Compound Name: | 2-(3-chloro-4-hydroxy-5-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
Molecular Weight: | 362.83 |
Molecular Formula: | C17 H15 Cl N2 O3 S |
Smiles: | COc1cc(cc(c1O)[Cl])C1NC(c2c3CCCCc3sc2N=1)=O |
Stereo: | ACHIRAL |
logP: | 3.742 |
logD: | 3.6941 |
logSw: | -4.2691 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.824 |
InChI Key: | GEGDMOGDFHBWBF-UHFFFAOYSA-N |