2-[5-(4-fluorophenyl)-2H-tetrazol-2-yl]-N'-({3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene)acetohydrazide
Chemical Structure Depiction of
2-[5-(4-fluorophenyl)-2H-tetrazol-2-yl]-N'-({3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene)acetohydrazide
2-[5-(4-fluorophenyl)-2H-tetrazol-2-yl]-N'-({3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene)acetohydrazide
Compound characteristics
| Compound ID: | 3277-0202 |
| Compound Name: | 2-[5-(4-fluorophenyl)-2H-tetrazol-2-yl]-N'-({3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene)acetohydrazide |
| Molecular Weight: | 532.49 |
| Molecular Formula: | C24 H21 F N10 O4 |
| Smiles: | CN1C(c2c(nc(n2C)Oc2cccc(/C=N/NC(Cn3nc(c4ccc(cc4)F)nn3)=O)c2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5165 |
| logD: | 2.5165 |
| logSw: | -2.9625 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 124.311 |
| InChI Key: | IBUSPMUDBANEQO-UHFFFAOYSA-N |