3-(3-bromophenyl)-5-({4-[(propan-2-yl)oxy]phenyl}methyl)-1,2,4-triazin-6(1H)-one
Chemical Structure Depiction of
3-(3-bromophenyl)-5-({4-[(propan-2-yl)oxy]phenyl}methyl)-1,2,4-triazin-6(1H)-one
3-(3-bromophenyl)-5-({4-[(propan-2-yl)oxy]phenyl}methyl)-1,2,4-triazin-6(1H)-one
Compound characteristics
| Compound ID: | G879-1494 |
| Compound Name: | 3-(3-bromophenyl)-5-({4-[(propan-2-yl)oxy]phenyl}methyl)-1,2,4-triazin-6(1H)-one |
| Molecular Weight: | 400.27 |
| Molecular Formula: | C19 H18 Br N3 O2 |
| Smiles: | CC(C)Oc1ccc(CC2C(NN=C(c3cccc(c3)[Br])N=2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3286 |
| logD: | 4.3285 |
| logSw: | -4.3539 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.111 |
| InChI Key: | AZIHPPZSXMCSPS-UHFFFAOYSA-N |