7-{3-[(cyclopropylmethyl)amino]-3-oxopropyl}-N-[(oxolan-2-yl)methyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
7-{3-[(cyclopropylmethyl)amino]-3-oxopropyl}-N-[(oxolan-2-yl)methyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
7-{3-[(cyclopropylmethyl)amino]-3-oxopropyl}-N-[(oxolan-2-yl)methyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | S629-2179 |
| Compound Name: | 7-{3-[(cyclopropylmethyl)amino]-3-oxopropyl}-N-[(oxolan-2-yl)methyl]-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C22 H31 N3 O4 |
| Smiles: | C1CC(CNC(N2CCOc3ccc(CCC(NCC4CC4)=O)cc3C2)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7229 |
| logD: | 1.7229 |
| logSw: | -2.3664 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.351 |
| InChI Key: | OCBAGPKANUCJCH-LJQANCHMSA-N |