(3S)-N-[(furan-2-yl)methyl]-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
(3S)-N-[(furan-2-yl)methyl]-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
(3S)-N-[(furan-2-yl)methyl]-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S979-0498 |
| Compound Name: | (3S)-N-[(furan-2-yl)methyl]-3-methyl-7-(morpholine-4-carbonyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C21 H25 N3 O5 |
| Smiles: | C[C@H]1COc2ccc(cc2CN1C(NCc1ccco1)=O)C(N1CCOCC1)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.9921 |
| logD: | 1.9921 |
| logSw: | -2.622 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.063 |
| InChI Key: | NKMLDOZEALXHDA-HNNXBMFYSA-N |