3-bromo-N-(7-butanoyl-2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
Chemical Structure Depiction of
3-bromo-N-(7-butanoyl-2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
3-bromo-N-(7-butanoyl-2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
Compound characteristics
Compound ID: | 8017-4732 |
Compound Name: | 3-bromo-N-(7-butanoyl-2,3-dihydro-1,4-benzodioxin-6-yl)benzamide |
Molecular Weight: | 404.26 |
Molecular Formula: | C19 H18 Br N O4 |
Smiles: | CCCC(c1cc2c(cc1NC(c1cccc(c1)[Br])=O)OCCO2)=O |
Stereo: | ACHIRAL |
logP: | 3.6399 |
logD: | 2.0946 |
logSw: | -3.8741 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.702 |
InChI Key: | QICWDMGKENTCIJ-UHFFFAOYSA-N |