N-ethyl-7-(3-oxo-3-{[(oxolan-2-yl)methyl]amino}propyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
N-ethyl-7-(3-oxo-3-{[(oxolan-2-yl)methyl]amino}propyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
N-ethyl-7-(3-oxo-3-{[(oxolan-2-yl)methyl]amino}propyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S629-0498 |
| Compound Name: | N-ethyl-7-(3-oxo-3-{[(oxolan-2-yl)methyl]amino}propyl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C20 H29 N3 O4 |
| Smiles: | CCNC(N1CCOc2ccc(CCC(NCC3CCCO3)=O)cc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1971 |
| logD: | 1.1971 |
| logSw: | -2.2427 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.726 |
| InChI Key: | YDZLNEPBXQYBKA-QGZVFWFLSA-N |