6'-amino-3'-methyl-2'H-spiro[cyclohexane-1,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Chemical Structure Depiction of
6'-amino-3'-methyl-2'H-spiro[cyclohexane-1,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
6'-amino-3'-methyl-2'H-spiro[cyclohexane-1,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile
Compound characteristics
| Compound ID: | Y500-0472 |
| Compound Name: | 6'-amino-3'-methyl-2'H-spiro[cyclohexane-1,4'-pyrano[2,3-c]pyrazole]-5'-carbonitrile |
| Molecular Weight: | 244.29 |
| Molecular Formula: | C13 H16 N4 O |
| Smiles: | Cc1c2c(n[nH]1)OC(=C(C#N)C21CCCCC1)N |
| Stereo: | ACHIRAL |
| logP: | 1.8246 |
| logD: | 1.8246 |
| logSw: | -1.7224 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.743 |
| InChI Key: | YCHIEBSYBGCZJU-UHFFFAOYSA-N |