benzyl 3-[2-(benzylamino)-2-oxoethyl]-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
benzyl 3-[2-(benzylamino)-2-oxoethyl]-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
benzyl 3-[2-(benzylamino)-2-oxoethyl]-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | V019-9512 |
| Compound Name: | benzyl 3-[2-(benzylamino)-2-oxoethyl]-7-methyl-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 509.63 |
| Molecular Formula: | C30 H27 N3 O3 S |
| Smiles: | CC1=C(C(c2ccccc2)N2C(CC(NCc3ccccc3)=O)=CSC2=N1)C(=O)OCc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1147 |
| logD: | 5.1146 |
| logSw: | -5.1924 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.714 |
| InChI Key: | JTLWWVNKQHYVRY-MUUNZHRXSA-N |