ethyl 2-({3,5-dibromo-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-({3,5-dibromo-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-({3,5-dibromo-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 8008-7944 |
| Compound Name: | ethyl 2-({3,5-dibromo-4-[(prop-2-en-1-yl)oxy]phenyl}methylidene)-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 698.43 |
| Molecular Formula: | C31 H26 Br2 N2 O5 S |
| Smiles: | CCOC(C1C(c2c(ccc3ccccc23)OC)N2C(=NC=1C)SC(=C\c1cc(c(c(c1)[Br])OCC=C)[Br])\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.3719 |
| logD: | 7.3719 |
| logSw: | -6.8176 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 60.697 |
| InChI Key: | IVTACEYAUFNDHX-MHZLTWQESA-N |