N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]-2-[2-methyl-3-(trifluoroacetyl)-1H-indol-1-yl]acetamide
Chemical Structure Depiction of
N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]-2-[2-methyl-3-(trifluoroacetyl)-1H-indol-1-yl]acetamide
N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]-2-[2-methyl-3-(trifluoroacetyl)-1H-indol-1-yl]acetamide
Compound characteristics
| Compound ID: | J031-1319 |
| Compound Name: | N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propyl]-2-[2-methyl-3-(trifluoroacetyl)-1H-indol-1-yl]acetamide |
| Molecular Weight: | 474.48 |
| Molecular Formula: | C25 H25 F3 N2 O4 |
| Smiles: | CCC(c1ccc2c(c1)OCCCO2)NC(Cn1c(C)c(C(C(F)(F)F)=O)c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3189 |
| logD: | 4.3189 |
| logSw: | -4.4536 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.434 |
| InChI Key: | GOHGNYCHTSMHOS-SFHVURJKSA-N |