methyl 3-{2-[benzyl(methyl)amino]-2-oxoethyl}-7-ethyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 3-{2-[benzyl(methyl)amino]-2-oxoethyl}-7-ethyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 3-{2-[benzyl(methyl)amino]-2-oxoethyl}-7-ethyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-8311 |
| Compound Name: | methyl 3-{2-[benzyl(methyl)amino]-2-oxoethyl}-7-ethyl-5-(4-nitrophenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 506.58 |
| Molecular Formula: | C26 H26 N4 O5 S |
| Smiles: | CCC1=C(C(c2ccc(cc2)[N+]([O-])=O)N2C(CC(N(C)Cc3ccccc3)=O)=CSC2=N1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5854 |
| logD: | 4.584 |
| logSw: | -4.5444 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.442 |
| InChI Key: | UDGAQQKXVNOJKB-XMMPIXPASA-N |