5-benzoyl-9-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-1,5-diazacycloundecan-2-one
Chemical Structure Depiction of
5-benzoyl-9-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-1,5-diazacycloundecan-2-one
5-benzoyl-9-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-1,5-diazacycloundecan-2-one
Compound characteristics
| Compound ID: | S733-2174 |
| Compound Name: | 5-benzoyl-9-(4-phenyl-3,6-dihydropyridine-1(2H)-carbonyl)-1,5-diazacycloundecan-2-one |
| Molecular Weight: | 459.59 |
| Molecular Formula: | C28 H33 N3 O3 |
| Smiles: | C1CC(CCNC(CCN(C1)C(c1ccccc1)=O)=O)C(N1CCC(=CC1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3073 |
| logD: | 2.3073 |
| logSw: | -2.7105 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.618 |
| InChI Key: | DHIKVRZIEGHDSV-VWLOTQADSA-N |