methyl 5-(4-chlorophenyl)-3-(2-{[2-(1,3-dioxolan-2-yl)ethyl]amino}-2-oxoethyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-(4-chlorophenyl)-3-(2-{[2-(1,3-dioxolan-2-yl)ethyl]amino}-2-oxoethyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(4-chlorophenyl)-3-(2-{[2-(1,3-dioxolan-2-yl)ethyl]amino}-2-oxoethyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V017-1003 |
| Compound Name: | methyl 5-(4-chlorophenyl)-3-(2-{[2-(1,3-dioxolan-2-yl)ethyl]amino}-2-oxoethyl)-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 477.97 |
| Molecular Formula: | C22 H24 Cl N3 O5 S |
| Smiles: | CC1=C(C(c2ccc(cc2)[Cl])N2C(CC(NCCC3OCCO3)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.148 |
| logD: | 2.1474 |
| logSw: | -3.2764 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.41 |
| InChI Key: | AKSSRWXJSLFODK-FQEVSTJZSA-N |