2-[(8-oxo-5,6,7,8-tetrahydro[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide
Chemical Structure Depiction of
2-[(8-oxo-5,6,7,8-tetrahydro[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide
2-[(8-oxo-5,6,7,8-tetrahydro[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide
Compound characteristics
| Compound ID: | C254-0024 |
| Compound Name: | 2-[(8-oxo-5,6,7,8-tetrahydro[1,3,4]thiadiazolo[3,2-a][1,3]diazepin-2-yl)sulfanyl]-N-(2,4,6-trimethylphenyl)acetamide |
| Molecular Weight: | 376.5 |
| Molecular Formula: | C17 H20 N4 O2 S2 |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(CSC1=NN2CCCC(N=C2S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5405 |
| logD: | 2.5405 |
| logSw: | -2.6638 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.401 |
| InChI Key: | CNBWDVUHNRYJKL-UHFFFAOYSA-N |