4-(2-fluorobenzene-1-sulfonyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(2-methylpropyl)-1,4-diazepane
Chemical Structure Depiction of
4-(2-fluorobenzene-1-sulfonyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(2-methylpropyl)-1,4-diazepane
4-(2-fluorobenzene-1-sulfonyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(2-methylpropyl)-1,4-diazepane
Compound characteristics
| Compound ID: | SA52-0140 |
| Compound Name: | 4-(2-fluorobenzene-1-sulfonyl)-2-(3-methyl-1,2,4-oxadiazol-5-yl)-1-(2-methylpropyl)-1,4-diazepane |
| Molecular Weight: | 396.48 |
| Molecular Formula: | C18 H25 F N4 O3 S |
| Smiles: | CC(C)CN1CCCN(CC1c1nc(C)no1)S(c1ccccc1F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7061 |
| logD: | 2.7057 |
| logSw: | -3.0175 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.176 |
| InChI Key: | XXGHWXCJAYMAGA-INIZCTEOSA-N |