(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl 3-(3-bromobenzamido)-4-chlorobenzoate
Chemical Structure Depiction of
(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl 3-(3-bromobenzamido)-4-chlorobenzoate
(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl 3-(3-bromobenzamido)-4-chlorobenzoate
Compound characteristics
| Compound ID: | G357-4921 |
| Compound Name: | (2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl 3-(3-bromobenzamido)-4-chlorobenzoate |
| Molecular Weight: | 516.73 |
| Molecular Formula: | C22 H15 Br Cl N3 O5 |
| Smiles: | CC1=CC2=NC(COC(c3ccc(c(c3)NC(c3cccc(c3)[Br])=O)[Cl])=O)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0322 |
| logD: | 3.9012 |
| logSw: | -4.3812 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.953 |
| InChI Key: | MLCGHVYCYIXABZ-UHFFFAOYSA-N |