6-chloro-7-hydroxy-6',6'-dimethyl-4-(thiophen-2-yl)-3,4-dihydrospiro[[1]benzopyran-2,4'-[1,3]diazinane]-2'-thione
Chemical Structure Depiction of
6-chloro-7-hydroxy-6',6'-dimethyl-4-(thiophen-2-yl)-3,4-dihydrospiro[[1]benzopyran-2,4'-[1,3]diazinane]-2'-thione
6-chloro-7-hydroxy-6',6'-dimethyl-4-(thiophen-2-yl)-3,4-dihydrospiro[[1]benzopyran-2,4'-[1,3]diazinane]-2'-thione
Compound characteristics
| Compound ID: | 8015-1546 |
| Compound Name: | 6-chloro-7-hydroxy-6',6'-dimethyl-4-(thiophen-2-yl)-3,4-dihydrospiro[[1]benzopyran-2,4'-[1,3]diazinane]-2'-thione |
| Molecular Weight: | 394.94 |
| Molecular Formula: | C18 H19 Cl N2 O2 S2 |
| Smiles: | CC1(C)CC2(CC(c3cc(c(cc3O2)O)[Cl])c2cccs2)NC(N1)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5245 |
| logD: | 4.4805 |
| logSw: | -4.2598 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 47.269 |
| InChI Key: | KTLBDBUVOUICSC-UHFFFAOYSA-N |