5-[(4-tert-butylphenyl)methoxy]-2-{[4-(3,4-dimethoxybenzoyl)-1,4-diazepan-1-yl]methyl}-4H-pyran-4-one
Chemical Structure Depiction of
5-[(4-tert-butylphenyl)methoxy]-2-{[4-(3,4-dimethoxybenzoyl)-1,4-diazepan-1-yl]methyl}-4H-pyran-4-one
5-[(4-tert-butylphenyl)methoxy]-2-{[4-(3,4-dimethoxybenzoyl)-1,4-diazepan-1-yl]methyl}-4H-pyran-4-one
Compound characteristics
| Compound ID: | V008-4007 |
| Compound Name: | 5-[(4-tert-butylphenyl)methoxy]-2-{[4-(3,4-dimethoxybenzoyl)-1,4-diazepan-1-yl]methyl}-4H-pyran-4-one |
| Molecular Weight: | 534.65 |
| Molecular Formula: | C31 H38 N2 O6 |
| Smiles: | CC(C)(C)c1ccc(COC2=COC(CN3CCCN(CC3)C(c3ccc(c(c3)OC)OC)=O)=CC2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9955 |
| logD: | 3.9921 |
| logSw: | -4.2028 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.931 |
| InChI Key: | UYELDPGNXOMLDG-UHFFFAOYSA-N |