5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxy-3-phenoxypropyl)(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxy-3-phenoxypropyl)(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxy-3-phenoxypropyl)(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V017-2480 |
| Compound Name: | 5-(3,4-dimethoxyphenyl)-2-{[(2-hydroxy-3-phenoxypropyl)(propan-2-yl)amino]methyl}thieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 509.62 |
| Molecular Formula: | C27 H31 N3 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)N(CC(COc1ccccc1)O)CC1NC(c2c(csc2N=1)c1ccc(c(c1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.901 |
| logD: | 3.8993 |
| logSw: | -4.3064 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.53 |
| InChI Key: | WBNCAWJHSSTSKP-IBGZPJMESA-N |