6',6'-dimethyl-2-phenyl-2'-sulfanylidene-2,3-dihydrospiro[[1]benzopyran-4,4'-[1,3]diazinan]-7-yl acetate
Chemical Structure Depiction of
6',6'-dimethyl-2-phenyl-2'-sulfanylidene-2,3-dihydrospiro[[1]benzopyran-4,4'-[1,3]diazinan]-7-yl acetate
6',6'-dimethyl-2-phenyl-2'-sulfanylidene-2,3-dihydrospiro[[1]benzopyran-4,4'-[1,3]diazinan]-7-yl acetate
Compound characteristics
| Compound ID: | 8008-6301 |
| Compound Name: | 6',6'-dimethyl-2-phenyl-2'-sulfanylidene-2,3-dihydrospiro[[1]benzopyran-4,4'-[1,3]diazinan]-7-yl acetate |
| Molecular Weight: | 396.51 |
| Molecular Formula: | C22 H24 N2 O3 S |
| Smiles: | CC(=O)Oc1ccc2c(c1)OC(CC21CC(C)(C)NC(N1)=S)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0357 |
| logD: | 4.0357 |
| logSw: | -4.296 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.691 |
| InChI Key: | AYSYGLFCZRLLKZ-UHFFFAOYSA-N |