4-benzoyl-8-(3,4-dichlorobenzoyl)-N-[(oxolan-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
Chemical Structure Depiction of
4-benzoyl-8-(3,4-dichlorobenzoyl)-N-[(oxolan-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
4-benzoyl-8-(3,4-dichlorobenzoyl)-N-[(oxolan-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide
Compound characteristics
Compound ID: | V002-5217 |
Compound Name: | 4-benzoyl-8-(3,4-dichlorobenzoyl)-N-[(oxolan-2-yl)methyl]-1-oxa-4,8-diazaspiro[4.5]decane-3-carboxamide |
Molecular Weight: | 546.45 |
Molecular Formula: | C27 H29 Cl2 N3 O5 |
Smiles: | C1CC(CNC(C2COC3(CCN(CC3)C(c3ccc(c(c3)[Cl])[Cl])=O)N2C(c2ccccc2)=O)=O)OC1 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.7055 |
logD: | 2.7055 |
logSw: | -3.6027 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.65 |
InChI Key: | OIRUHUVOFAOJQW-UHFFFAOYSA-N |