1-[4-(3-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]-2-phenylbutan-1-one
Chemical Structure Depiction of
1-[4-(3-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]-2-phenylbutan-1-one
1-[4-(3-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]-2-phenylbutan-1-one
Compound characteristics
| Compound ID: | V003-3724 |
| Compound Name: | 1-[4-(3-methoxy-7-methyldibenzo[b,f][1,4]oxazepin-11-yl)-1,4-diazepan-1-yl]-2-phenylbutan-1-one |
| Molecular Weight: | 483.61 |
| Molecular Formula: | C30 H33 N3 O3 |
| Smiles: | CCC(C(N1CCCN(CC1)C1c2ccc(cc2Oc2cc(C)ccc2N=1)OC)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6854 |
| logD: | 4.6958 |
| logSw: | -5.5252 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.593 |
| InChI Key: | ITJXYVUTEZSVSD-XMMPIXPASA-N |