8-({[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-5-ethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Chemical Structure Depiction of
8-({[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-5-ethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
8-({[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-5-ethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine
Compound characteristics
Compound ID: | E514-0736 |
Compound Name: | 8-({[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]methyl}sulfanyl)-5-ethylfuro[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazine |
Molecular Weight: | 469.36 |
Molecular Formula: | C21 H17 Br N4 O2 S |
Smiles: | CCc1nnc(c2cc3c(cco3)n12)SCc1c(C)oc(c2cccc(c2)[Br])n1 |
Stereo: | ACHIRAL |
logP: | 5.1194 |
logD: | 5.1154 |
logSw: | -5.1241 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 47.889 |
InChI Key: | DWKLPMHTXJOVFW-UHFFFAOYSA-N |