ethyl [4-({[2-(4-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}carbamamido)phenyl]acetate
Chemical Structure Depiction of
ethyl [4-({[2-(4-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}carbamamido)phenyl]acetate
ethyl [4-({[2-(4-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}carbamamido)phenyl]acetate
Compound characteristics
| Compound ID: | F524-0171 |
| Compound Name: | ethyl [4-({[2-(4-methylphenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}carbamamido)phenyl]acetate |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C24 H23 N5 O4 S |
| Smiles: | CCOC(Cc1ccc(cc1)NC(NCC1=CC(N2C(=N1)SC(c1ccc(C)cc1)=N2)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4799 |
| logD: | 3.476 |
| logSw: | -3.6644 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.055 |
| InChI Key: | KMGHRSPRJOKLMC-UHFFFAOYSA-N |