propan-2-yl 3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-5-(2-chlorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
propan-2-yl 3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-5-(2-chlorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
propan-2-yl 3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-5-(2-chlorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-9952 |
| Compound Name: | propan-2-yl 3-(2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-oxoethyl)-5-(2-chlorophenyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 540.04 |
| Molecular Formula: | C27 H26 Cl N3 O5 S |
| Smiles: | CC(C)OC(C1C(c2ccccc2[Cl])N2C(CC(NCc3ccc4c(c3)OCO4)=O)=CSC2=NC=1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9724 |
| logD: | 4.9711 |
| logSw: | -5.0535 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.405 |
| InChI Key: | GYOHWUDGIRWGTB-VWLOTQADSA-N |