(2-methylpyridin-4-yl)[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Chemical Structure Depiction of
(2-methylpyridin-4-yl)[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
(2-methylpyridin-4-yl)[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone
Compound characteristics
Compound ID: | SC09-0545 |
Compound Name: | (2-methylpyridin-4-yl)[(3S)-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]methanone |
Molecular Weight: | 359.43 |
Molecular Formula: | C22 H21 N3 O2 |
Smiles: | Cc1cc(ccn1)C(N1Cc2cc(ccc2OC[C@@H]1C)c1cccnc1)=O |
Stereo: | ABSOLUTE |
logP: | 3.1515 |
logD: | 3.1401 |
logSw: | -2.7385 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 42.715 |
InChI Key: | UUMHIQUYVBMURI-INIZCTEOSA-N |