4-methyl-3-(1H-tetrazol-5-yl)-1-oxaspiro[4.4]non-3-en-2-one
Chemical Structure Depiction of
4-methyl-3-(1H-tetrazol-5-yl)-1-oxaspiro[4.4]non-3-en-2-one
4-methyl-3-(1H-tetrazol-5-yl)-1-oxaspiro[4.4]non-3-en-2-one
Compound characteristics
| Compound ID: | 8016-9320 |
| Compound Name: | 4-methyl-3-(1H-tetrazol-5-yl)-1-oxaspiro[4.4]non-3-en-2-one |
| Molecular Weight: | 220.23 |
| Molecular Formula: | C10 H12 N4 O2 |
| Smiles: | CC1=C(C(=O)OC12CCCC2)c1nnn[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 0.861 |
| logD: | -3.5607 |
| logSw: | -0.6963 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.543 |
| InChI Key: | YDUHDFUNNRKUFK-UHFFFAOYSA-N |