{4-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
{4-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone
{4-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | M400-0401 |
| Compound Name: | {4-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 368.48 |
| Molecular Formula: | C21 H28 N4 O2 |
| Smiles: | CCn1c(C)c(CN2CCOc3ccc(cc3C2)C(N2CCCC2)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 1.9679 |
| logD: | -1.9064 |
| logSw: | -2.257 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.855 |
| InChI Key: | AZVZWDRJAXJJPG-UHFFFAOYSA-N |