[(3S)-3-methyl-4-(4-methyl-1,3-oxazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
[(3S)-3-methyl-4-(4-methyl-1,3-oxazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone
[(3S)-3-methyl-4-(4-methyl-1,3-oxazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | S979-0352 |
| Compound Name: | [(3S)-3-methyl-4-(4-methyl-1,3-oxazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl](pyrrolidin-1-yl)methanone |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C20 H23 N3 O4 |
| Smiles: | Cc1c(C(N2Cc3cc(ccc3OC[C@@H]2C)C(N2CCCC2)=O)=O)ocn1 |
| Stereo: | ABSOLUTE |
| logP: | 1.8024 |
| logD: | 1.8024 |
| logSw: | -2.2237 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.542 |
| InChI Key: | UAJJBAZYTDUAOH-CYBMUJFWSA-N |