benzyl 3-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-7-methyl-5-(3-phenoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 3-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-7-methyl-5-(3-phenoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 3-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-7-methyl-5-(3-phenoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-6796 |
| Compound Name: | benzyl 3-{2-[(2-methoxyethyl)amino]-2-oxoethyl}-7-methyl-5-(3-phenoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 569.68 |
| Molecular Formula: | C32 H31 N3 O5 S |
| Smiles: | CC1=C(C(c2cccc(c2)Oc2ccccc2)N2C(CC(NCCOC)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0872 |
| logD: | 5.0871 |
| logSw: | -5.1432 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.917 |
| InChI Key: | WHMMVSGCCPXINO-SSEXGKCCSA-N |