6',6'-dimethyl-2'-(methylsulfanyl)-2-phenyl-2,3,5',6'-tetrahydro-1'H-spiro[[1]benzopyran-4,4'-pyrimidin]-7-ol
Chemical Structure Depiction of
6',6'-dimethyl-2'-(methylsulfanyl)-2-phenyl-2,3,5',6'-tetrahydro-1'H-spiro[[1]benzopyran-4,4'-pyrimidin]-7-ol
6',6'-dimethyl-2'-(methylsulfanyl)-2-phenyl-2,3,5',6'-tetrahydro-1'H-spiro[[1]benzopyran-4,4'-pyrimidin]-7-ol
Compound characteristics
| Compound ID: | 8009-8356 |
| Compound Name: | 6',6'-dimethyl-2'-(methylsulfanyl)-2-phenyl-2,3,5',6'-tetrahydro-1'H-spiro[[1]benzopyran-4,4'-pyrimidin]-7-ol |
| Molecular Weight: | 368.5 |
| Molecular Formula: | C21 H24 N2 O2 S |
| Smiles: | CC1(C)CC2(CC(c3ccccc3)Oc3cc(ccc23)O)N=C(N1)SC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7001 |
| logD: | 2.3487 |
| logSw: | -4.4621 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 46.226 |
| InChI Key: | IKQVAWAYEBGDCK-UHFFFAOYSA-N |