4-{[2-(3-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-(3-methoxyphenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-{[2-(3-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-(3-methoxyphenyl)piperazine-1-carboxamide
4-{[2-(3-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-(3-methoxyphenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | G768-1263 |
| Compound Name: | 4-{[2-(3-chlorophenyl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl]methyl}-N-(3-methoxyphenyl)piperazine-1-carboxamide |
| Molecular Weight: | 511 |
| Molecular Formula: | C24 H23 Cl N6 O3 S |
| Smiles: | COc1cccc(c1)NC(N1CCN(CC1)CC1=CC(N2C(=N1)SC(c1cccc(c1)[Cl])=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3742 |
| logD: | 3.2897 |
| logSw: | -3.7659 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.824 |
| InChI Key: | MNGQRYHFSASXOI-UHFFFAOYSA-N |