2-(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{[1-(3-methylbenzoyl)-2,3-dihydro-1H-indol-5-yl]methyl}acetamide
Chemical Structure Depiction of
2-(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{[1-(3-methylbenzoyl)-2,3-dihydro-1H-indol-5-yl]methyl}acetamide
2-(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{[1-(3-methylbenzoyl)-2,3-dihydro-1H-indol-5-yl]methyl}acetamide
Compound characteristics
| Compound ID: | G883-1545 |
| Compound Name: | 2-(6-tert-butyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)-N-{[1-(3-methylbenzoyl)-2,3-dihydro-1H-indol-5-yl]methyl}acetamide |
| Molecular Weight: | 511.62 |
| Molecular Formula: | C31 H33 N3 O4 |
| Smiles: | Cc1cccc(c1)C(N1CCc2cc(CNC(CN3C(COc4ccc(cc34)C(C)(C)C)=O)=O)ccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6189 |
| logD: | 4.6189 |
| logSw: | -4.3405 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.218 |
| InChI Key: | DMHDLUPJRGMDMD-UHFFFAOYSA-N |