methyl 5-(4-chlorophenyl)-7-methyl-3-{2-oxo-2-[(3-phenylpropyl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-(4-chlorophenyl)-7-methyl-3-{2-oxo-2-[(3-phenylpropyl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(4-chlorophenyl)-7-methyl-3-{2-oxo-2-[(3-phenylpropyl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V012-2713 |
| Compound Name: | methyl 5-(4-chlorophenyl)-7-methyl-3-{2-oxo-2-[(3-phenylpropyl)amino]ethyl}-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 496.03 |
| Molecular Formula: | C26 H26 Cl N3 O3 S |
| Smiles: | CC1=C(C(c2ccc(cc2)[Cl])N2C(CC(NCCCc3ccccc3)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.942 |
| logD: | 4.9414 |
| logSw: | -5.2234 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.872 |
| InChI Key: | NEGWCPWQMHFJHM-DEOSSOPVSA-N |