7-butyl-3-methyl-8-[2-(4-phenylbut-3-en-2-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-butyl-3-methyl-8-[2-(4-phenylbut-3-en-2-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
7-butyl-3-methyl-8-[2-(4-phenylbut-3-en-2-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 0950-0413 |
| Compound Name: | 7-butyl-3-methyl-8-[2-(4-phenylbut-3-en-2-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 380.45 |
| Molecular Formula: | C20 H24 N6 O2 |
| Smiles: | CCCCn1c2C(NC(N(C)c2nc1N/N=C(/C)/C=C/c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2361 |
| logD: | 4.2342 |
| logSw: | -3.9061 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.281 |
| InChI Key: | WJRCSOCSYNHPIQ-KGECZUTASA-N |