methyl 3-[2-(benzylamino)-2-oxoethyl]-5-[4-(benzyloxy)-3-methoxyphenyl]-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-[2-(benzylamino)-2-oxoethyl]-5-[4-(benzyloxy)-3-methoxyphenyl]-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 3-[2-(benzylamino)-2-oxoethyl]-5-[4-(benzyloxy)-3-methoxyphenyl]-7-methyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V021-5716 |
| Compound Name: | methyl 3-[2-(benzylamino)-2-oxoethyl]-5-[4-(benzyloxy)-3-methoxyphenyl]-7-methyl-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(c2ccc(c(c2)OC)OCc2ccccc2)N2C(CC(NCc3ccccc3)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7996 |
| logD: | 4.799 |
| logSw: | -4.9473 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.975 |
| InChI Key: | JNMXDFPQRMAMHC-SSEXGKCCSA-N |