N-[5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide
Chemical Structure Depiction of
N-[5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide
N-[5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide
Compound characteristics
| Compound ID: | D026-0060 |
| Compound Name: | N-[5-(4-methylphenyl)-6H-1,3,4-thiadiazin-2-yl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamide |
| Molecular Weight: | 451.57 |
| Molecular Formula: | C21 H21 N7 O S2 |
| Smiles: | CCC(C(NC1=NN=C(CS1)c1ccc(C)cc1)=O)Sc1nnnn1c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7702 |
| logD: | 4.7696 |
| logSw: | -4.5001 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.935 |
| InChI Key: | GYFINYNELYCNQR-SFHVURJKSA-N |