2-({[3-(4-chlorophenoxy)-2-hydroxypropyl](3-methoxypropyl)amino}methyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-({[3-(4-chlorophenoxy)-2-hydroxypropyl](3-methoxypropyl)amino}methyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-({[3-(4-chlorophenoxy)-2-hydroxypropyl](3-methoxypropyl)amino}methyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V009-2662 |
| Compound Name: | 2-({[3-(4-chlorophenoxy)-2-hydroxypropyl](3-methoxypropyl)amino}methyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 506.06 |
| Molecular Formula: | C25 H32 Cl N3 O4 S |
| Salt: | not_available |
| Smiles: | CC1CCc2c3C(NC(CN(CCCOC)CC(COc4ccc(cc4)[Cl])O)=Nc3sc2C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4204 |
| logD: | 4.4196 |
| logSw: | -4.5272 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.146 |
| InChI Key: | XTEXSJNNNWJCPS-UHFFFAOYSA-N |