6-amino-3-(methoxymethyl)-2H-spiro[pyrano[2,3-c]pyrazole-4,4'-thiane]-5-carbonitrile
Chemical Structure Depiction of
6-amino-3-(methoxymethyl)-2H-spiro[pyrano[2,3-c]pyrazole-4,4'-thiane]-5-carbonitrile
6-amino-3-(methoxymethyl)-2H-spiro[pyrano[2,3-c]pyrazole-4,4'-thiane]-5-carbonitrile
Compound characteristics
| Compound ID: | 8015-8227 |
| Compound Name: | 6-amino-3-(methoxymethyl)-2H-spiro[pyrano[2,3-c]pyrazole-4,4'-thiane]-5-carbonitrile |
| Molecular Weight: | 292.36 |
| Molecular Formula: | C13 H16 N4 O2 S |
| Smiles: | COCc1c2c(n[nH]1)OC(=C(C#N)C21CCSCC1)N |
| Stereo: | ACHIRAL |
| logP: | 0.631 |
| logD: | 0.631 |
| logSw: | -1.1696 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.856 |
| InChI Key: | WNXWUQRVNFZHIJ-UHFFFAOYSA-N |