2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(2-methylpropyl)-4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4-diazepane
Chemical Structure Depiction of
2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(2-methylpropyl)-4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4-diazepane
2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(2-methylpropyl)-4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4-diazepane
Compound characteristics
| Compound ID: | SA52-1155 |
| Compound Name: | 2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(2-methylpropyl)-4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)-1,4-diazepane |
| Molecular Weight: | 432.58 |
| Molecular Formula: | C22 H32 N4 O3 S |
| Smiles: | CC(C)CN1CCCN(CC1c1nc(C)no1)S(c1ccc2CCCCc2c1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1856 |
| logD: | 4.1852 |
| logSw: | -4.2375 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.096 |
| InChI Key: | AJCHJNRKNDTAQC-NRFANRHFSA-N |