1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-4-[(3-methylphenyl)methyl]-1,4-diazepane--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-4-[(3-methylphenyl)methyl]-1,4-diazepane--hydrogen chloride (1/1)
1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-4-[(3-methylphenyl)methyl]-1,4-diazepane--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | P891-0028 |
| Compound Name: | 1-[3-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-4-[(3-methylphenyl)methyl]-1,4-diazepane--hydrogen chloride (1/1) |
| Molecular Weight: | 399.92 |
| Molecular Formula: | C21 H25 N5 O |
| Salt: | HCl |
| Smiles: | Cc1cccc(CN2CCCN(CC2)c2c(cccn2)c2nc(C)no2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.605 |
| logD: | 3.194 |
| logSw: | -3.6007 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.833 |
| InChI Key: | HUFZZWCUUVGETQ-UHFFFAOYSA-N |