2-chloro-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]acetamide
Chemical Structure Depiction of
2-chloro-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]acetamide
2-chloro-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]acetamide
Compound characteristics
Compound ID: | J031-2323 |
Compound Name: | 2-chloro-N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]acetamide |
Molecular Weight: | 297.78 |
Molecular Formula: | C15 H20 Cl N O3 |
Smiles: | CC(C)C(c1ccc2c(c1)OCCCO2)NC(C[Cl])=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.3071 |
logD: | 2.3071 |
logSw: | -2.9127 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 40.216 |
InChI Key: | XMUMZMQOEWGUCN-HNNXBMFYSA-N |