4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-{[4-(propan-2-yl)phenyl]methyl}-1,4-diazepane
Chemical Structure Depiction of
4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-{[4-(propan-2-yl)phenyl]methyl}-1,4-diazepane
4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-{[4-(propan-2-yl)phenyl]methyl}-1,4-diazepane
Compound characteristics
| Compound ID: | S990-0506 |
| Compound Name: | 4-(methanesulfonyl)-5-(3-methyl-1,2,4-oxadiazol-5-yl)-1-{[4-(propan-2-yl)phenyl]methyl}-1,4-diazepane |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C19 H28 N4 O3 S |
| Smiles: | CC(C)c1ccc(CN2CCC(c3nc(C)no3)N(CC2)S(C)(=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8454 |
| logD: | 2.8392 |
| logSw: | -3.1663 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.346 |
| InChI Key: | LHXWIBNXWVOCGK-SFHVURJKSA-N |