6-amino-3,3-dimethyl-8-sulfanylidene-4,8-dihydro-1H,3H-thiopyrano[3,4-c]pyran-5-carbonitrile
Chemical Structure Depiction of
6-amino-3,3-dimethyl-8-sulfanylidene-4,8-dihydro-1H,3H-thiopyrano[3,4-c]pyran-5-carbonitrile
6-amino-3,3-dimethyl-8-sulfanylidene-4,8-dihydro-1H,3H-thiopyrano[3,4-c]pyran-5-carbonitrile
Compound characteristics
| Compound ID: | 3966-1087 |
| Compound Name: | 6-amino-3,3-dimethyl-8-sulfanylidene-4,8-dihydro-1H,3H-thiopyrano[3,4-c]pyran-5-carbonitrile |
| Molecular Weight: | 252.35 |
| Molecular Formula: | C11 H12 N2 O S2 |
| Smiles: | CC1(C)CC2=C(CO1)C(=S)SC(=C2C#N)N |
| Stereo: | ACHIRAL |
| logP: | 2.2397 |
| logD: | 2.2397 |
| logSw: | -2.0279 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 45.18 |
| InChI Key: | TZABRSKNZQQCGP-UHFFFAOYSA-N |