(4-tert-butylphenyl){4-[3-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
(4-tert-butylphenyl){4-[3-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}methanone
(4-tert-butylphenyl){4-[3-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
Compound ID: | P891-1561 |
Compound Name: | (4-tert-butylphenyl){4-[3-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}methanone |
Molecular Weight: | 433.55 |
Molecular Formula: | C25 H31 N5 O2 |
Smiles: | CCc1nc(c2cccnc2N2CCCN(CC2)C(c2ccc(cc2)C(C)(C)C)=O)on1 |
Stereo: | ACHIRAL |
logP: | 4.8905 |
logD: | 4.6648 |
logSw: | -4.4527 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 62.127 |
InChI Key: | FHLGPXQBXGBMQJ-UHFFFAOYSA-N |