methyl 1-(2-{[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]amino}-2-oxoethyl)-1H-indole-3-carboxylate
Chemical Structure Depiction of
methyl 1-(2-{[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]amino}-2-oxoethyl)-1H-indole-3-carboxylate
methyl 1-(2-{[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]amino}-2-oxoethyl)-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | J031-1324 |
| Compound Name: | methyl 1-(2-{[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]amino}-2-oxoethyl)-1H-indole-3-carboxylate |
| Molecular Weight: | 408.45 |
| Molecular Formula: | C23 H24 N2 O5 |
| Smiles: | CC(c1ccc2c(c1)OCCCO2)NC(Cn1cc(C(=O)OC)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.883 |
| logD: | 2.883 |
| logSw: | -3.1564 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.933 |
| InChI Key: | UZVGJWOMTKDIBZ-HNNXBMFYSA-N |