6-benzyl-N-[(5-bromo-2-methoxyphenyl)methyl]-7-oxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide
Chemical Structure Depiction of
6-benzyl-N-[(5-bromo-2-methoxyphenyl)methyl]-7-oxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide
6-benzyl-N-[(5-bromo-2-methoxyphenyl)methyl]-7-oxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | L521-1690 |
| Compound Name: | 6-benzyl-N-[(5-bromo-2-methoxyphenyl)methyl]-7-oxo-6,7-dihydro[1,2]thiazolo[4,3-d]pyrimidine-3-carboxamide |
| Molecular Weight: | 485.36 |
| Molecular Formula: | C21 H17 Br N4 O3 S |
| Smiles: | COc1ccc(cc1CNC(c1c2c(C(N(Cc3ccccc3)C=N2)=O)ns1)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 3.372 |
| logD: | 3.3678 |
| logSw: | -3.7214 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.483 |
| InChI Key: | RQGISYGLVDDKMD-UHFFFAOYSA-N |