2-nitro-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]benzamide
Chemical Structure Depiction of
2-nitro-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]benzamide
2-nitro-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]benzamide
Compound characteristics
| Compound ID: | Y032-3665 |
| Compound Name: | 2-nitro-N-[5-(pentan-2-yl)-1,3,4-thiadiazol-2-yl]benzamide |
| Molecular Weight: | 320.37 |
| Molecular Formula: | C14 H16 N4 O3 S |
| Smiles: | CCCC(C)c1nnc(NC(c2ccccc2[N+]([O-])=O)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6422 |
| logD: | 0.5609 |
| logSw: | -3.9732 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.955 |
| InChI Key: | AFULMXYHTRFEMQ-VIFPVBQESA-N |