2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-7-phenyl-3-(prop-2-en-1-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Chemical Structure Depiction of
2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-7-phenyl-3-(prop-2-en-1-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-7-phenyl-3-(prop-2-en-1-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C200-7994 |
| Compound Name: | 2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-7-phenyl-3-(prop-2-en-1-yl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C24 H23 N3 O2 S |
| Smiles: | Cn1cc(c2ccccc2)c2c1C(N(CC=C)C(=N2)SCc1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7285 |
| logD: | 4.7285 |
| logSw: | -4.5114 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.738 |
| InChI Key: | OQTWHSHSFKSULN-UHFFFAOYSA-N |