N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylphenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylphenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylphenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
Compound characteristics
Compound ID: | E475-1013 |
Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-methylphenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide |
Molecular Weight: | 403.48 |
Molecular Formula: | C24 H25 N3 O3 |
Smiles: | Cc1ccc(cc1)c1nc(C(Nc2ccc3c(c2)OCCO3)=O)c2CCCCCn12 |
Stereo: | ACHIRAL |
logP: | 4.3756 |
logD: | 4.3754 |
logSw: | -4.2536 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.993 |
InChI Key: | HKXORAYAFNDGNQ-UHFFFAOYSA-N |