N-benzyl-1-[(5-methylfuran-2-yl)methyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-[(5-methylfuran-2-yl)methyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-[(5-methylfuran-2-yl)methyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0852 |
| Compound Name: | N-benzyl-1-[(5-methylfuran-2-yl)methyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 397.52 |
| Molecular Formula: | C23 H31 N3 O3 |
| Smiles: | Cc1ccc(CN2CCCC(CCNC(CC2)=O)C(NCc2ccccc2)=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4047 |
| logD: | 0.5386 |
| logSw: | -1.9146 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.002 |
| InChI Key: | VMSZNKBOXSHUMB-FQEVSTJZSA-N |