N-(5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide
Chemical Structure Depiction of
N-(5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide
N-(5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide
Compound characteristics
| Compound ID: | V014-6677 |
| Compound Name: | N-(5-{[(2,6-dichlorophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-ethylhexanamide |
| Molecular Weight: | 418.41 |
| Molecular Formula: | C17 H21 Cl2 N3 O S2 |
| Smiles: | CCCCC(CC)C(Nc1nnc(SCc2c(cccc2[Cl])[Cl])s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9119 |
| logD: | 6.9055 |
| logSw: | -6.3604 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.236 |
| InChI Key: | NSZQFNHBAXEOTG-NSHDSACASA-N |