7,8-dihydroxy-6',6'-dimethyl-4-(thiophen-2-yl)-3,4-dihydrospiro[[1]benzopyran-2,4'-[1,3]diazinane]-2'-thione
Chemical Structure Depiction of
7,8-dihydroxy-6',6'-dimethyl-4-(thiophen-2-yl)-3,4-dihydrospiro[[1]benzopyran-2,4'-[1,3]diazinane]-2'-thione
7,8-dihydroxy-6',6'-dimethyl-4-(thiophen-2-yl)-3,4-dihydrospiro[[1]benzopyran-2,4'-[1,3]diazinane]-2'-thione
Compound characteristics
| Compound ID: | 8015-5587 |
| Compound Name: | 7,8-dihydroxy-6',6'-dimethyl-4-(thiophen-2-yl)-3,4-dihydrospiro[[1]benzopyran-2,4'-[1,3]diazinane]-2'-thione |
| Molecular Weight: | 376.49 |
| Molecular Formula: | C18 H20 N2 O3 S2 |
| Smiles: | CC1(C)CC2(CC(c3ccc(c(c3O2)O)O)c2cccs2)NC(N1)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6958 |
| logD: | 3.6896 |
| logSw: | -3.778 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 62.433 |
| InChI Key: | KASDRFHIUMIOQD-UHFFFAOYSA-N |