2-{[(4-fluorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)-5-methyl-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
2-{[(4-fluorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)-5-methyl-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
2-{[(4-fluorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)-5-methyl-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C200-8000 |
| Compound Name: | 2-{[(4-fluorophenyl)methyl]sulfanyl}-3-(3-methoxypropyl)-5-methyl-7-phenyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 437.54 |
| Molecular Formula: | C24 H24 F N3 O2 S |
| Smiles: | Cn1cc(c2ccccc2)c2c1C(N(CCCOC)C(=N2)SCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.133 |
| logD: | 4.133 |
| logSw: | -4.1206 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.537 |
| InChI Key: | LEKKGXIKNWQOCA-UHFFFAOYSA-N |