N-benzyl-1-({3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyphenyl}methyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-({3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyphenyl}methyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-({3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyphenyl}methyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0904 |
| Compound Name: | N-benzyl-1-({3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-methoxyphenyl}methyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 532.68 |
| Molecular Formula: | C31 H40 N4 O4 |
| Smiles: | Cc1c(Cc2cc(CN3CCCC(CCNC(CC3)=O)C(NCc3ccccc3)=O)ccc2OC)c(C)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4785 |
| logD: | 2.109 |
| logSw: | -2.81 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.136 |
| InChI Key: | CAXBFYHFHKPNEB-SANMLTNESA-N |