N-[2-(butan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]-4-chlorobenzamide
Chemical Structure Depiction of
N-[2-(butan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]-4-chlorobenzamide
N-[2-(butan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]-4-chlorobenzamide
Compound characteristics
| Compound ID: | 8629-0098 |
| Compound Name: | N-[2-(butan-2-yl)-5-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6-yl]-4-chlorobenzamide |
| Molecular Weight: | 362.84 |
| Molecular Formula: | C16 H15 Cl N4 O2 S |
| Smiles: | CCC(C)C1=NN2C(=NC=C(C2=O)NC(c2ccc(cc2)[Cl])=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2843 |
| logD: | 1.3023 |
| logSw: | -3.7892 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.846 |
| InChI Key: | LMFUFBDWGPSBKJ-VIFPVBQESA-N |