6-[2-({3-iodo-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)hydrazinyl]-N-(4-iodophenyl)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
Chemical Structure Depiction of
6-[2-({3-iodo-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)hydrazinyl]-N-(4-iodophenyl)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
6-[2-({3-iodo-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)hydrazinyl]-N-(4-iodophenyl)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
Compound characteristics
| Compound ID: | 2144-0921 |
| Compound Name: | 6-[2-({3-iodo-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)hydrazinyl]-N-(4-iodophenyl)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine |
| Molecular Weight: | 667.2 |
| Molecular Formula: | C21 H15 I2 N7 O3 |
| Smiles: | COc1cc(/C=N/Nc2c(Nc3ccc(cc3)I)nc3c(n2)non3)cc(c1OCC#C)I |
| Stereo: | ACHIRAL |
| logP: | 6.7868 |
| logD: | 6.7867 |
| logSw: | -5.8355 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.992 |
| InChI Key: | OPYPKFVQCXLRGH-UHFFFAOYSA-N |