3-(5-{5-[(3-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(5-{5-[(3-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
3-(5-{5-[(3-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | L701-0123 |
| Compound Name: | 3-(5-{5-[(3-chloro-4-methoxyphenyl)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 466.93 |
| Molecular Formula: | C23 H23 Cl N6 O3 |
| Smiles: | COc1ccc(Cc2nc(c3ccc4c(c3)nnn4CCC(N3CCCC3)=O)no2)cc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.6702 |
| logD: | 3.6702 |
| logSw: | -4.1013 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.103 |
| InChI Key: | ICJALWUVJNMPKG-UHFFFAOYSA-N |