3-(1,3-benzothiazol-2-yl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]propan-1-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]propan-1-one
3-(1,3-benzothiazol-2-yl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]propan-1-one
Compound characteristics
| Compound ID: | SA52-1152 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)-4-(2-methylpropyl)-1,4-diazepan-1-yl]propan-1-one |
| Molecular Weight: | 427.57 |
| Molecular Formula: | C22 H29 N5 O2 S |
| Smiles: | CC(C)CN1CCCN(CC1c1nc(C)no1)C(CCc1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6272 |
| logD: | 3.5959 |
| logSw: | -3.7934 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.801 |
| InChI Key: | BGEGSJMLBYNYJE-SFHVURJKSA-N |