ethyl 9-[3-(benzyloxy)-3-oxopropyl]-6-{[4-(benzyloxy)phenyl]methyl}-2,2-dimethyl-4,7,10-trioxo-3-oxa-5,8,11-triazatridecan-13-oate
Chemical Structure Depiction of
ethyl 9-[3-(benzyloxy)-3-oxopropyl]-6-{[4-(benzyloxy)phenyl]methyl}-2,2-dimethyl-4,7,10-trioxo-3-oxa-5,8,11-triazatridecan-13-oate
ethyl 9-[3-(benzyloxy)-3-oxopropyl]-6-{[4-(benzyloxy)phenyl]methyl}-2,2-dimethyl-4,7,10-trioxo-3-oxa-5,8,11-triazatridecan-13-oate
Compound characteristics
| Compound ID: | 6623-2048 |
| Compound Name: | ethyl 9-[3-(benzyloxy)-3-oxopropyl]-6-{[4-(benzyloxy)phenyl]methyl}-2,2-dimethyl-4,7,10-trioxo-3-oxa-5,8,11-triazatridecan-13-oate |
| Molecular Weight: | 675.78 |
| Molecular Formula: | C37 H45 N3 O9 |
| Smiles: | CCOC(CNC(C(CCC(=O)OCc1ccccc1)NC(C(Cc1ccc(cc1)OCc1ccccc1)NC(=O)OC(C)(C)C)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.111 |
| logD: | 6.111 |
| logSw: | -5.5428 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 128.393 |
| InChI Key: | MOTLCNNVGQNBIJ-UHFFFAOYSA-N |