1,3-dimethyl-7-(prop-2-en-1-yl)-8-[4-(1H-tetrazol-5-yl)phenoxy]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-7-(prop-2-en-1-yl)-8-[4-(1H-tetrazol-5-yl)phenoxy]-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-7-(prop-2-en-1-yl)-8-[4-(1H-tetrazol-5-yl)phenoxy]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7286-2366 |
| Compound Name: | 1,3-dimethyl-7-(prop-2-en-1-yl)-8-[4-(1H-tetrazol-5-yl)phenoxy]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 380.36 |
| Molecular Formula: | C17 H16 N8 O3 |
| Smiles: | CN1C(c2c(nc(n2CC=C)Oc2ccc(cc2)c2nnn[nH]2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2507 |
| logD: | -0.7526 |
| logSw: | -2.7234 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.115 |
| InChI Key: | NNSXNFKHHUZEHP-UHFFFAOYSA-N |