4,10-bis[(4-nitrophenyl)methyl]-1,7-dioxa-4,10-diazacyclododecane
Chemical Structure Depiction of
4,10-bis[(4-nitrophenyl)methyl]-1,7-dioxa-4,10-diazacyclododecane
4,10-bis[(4-nitrophenyl)methyl]-1,7-dioxa-4,10-diazacyclododecane
Compound characteristics
| Compound ID: | 0495-0077 |
| Compound Name: | 4,10-bis[(4-nitrophenyl)methyl]-1,7-dioxa-4,10-diazacyclododecane |
| Molecular Weight: | 444.49 |
| Molecular Formula: | C22 H28 N4 O6 |
| Smiles: | C1COCCN(CCOCCN1Cc1ccc(cc1)[N+]([O-])=O)Cc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6778 |
| logD: | 2.6576 |
| logSw: | -2.7113 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 90.423 |
| InChI Key: | IMMZWSVMUMZQDX-UHFFFAOYSA-N |