Nlrbs-dppc
2-[3-(diethylamino)-6-diethylazaniumylidenexanthen-9-yl]-5-[2-[2,3-di(hexadecanoyloxy)propoxy-hydroxyphosphoryl]oxyethylsulfamoyl]benzenesulfonate
| Molecular Formula | C64H102N3O14PS2 |
|---|---|
| Molecular Weight | 1232.6 g/mol |
| LogP | 15.7 |
| Topological Polar Surface Area | 244.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 48 |
| Exact Mass | 1231.654 |
| Heavy Atoms | 84 |
| Complexity | 2240.0 |
Chemical Identifiers
| CAS Number | 115044-45-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCNS(=O)(=O)C1=CC(=C(C=C1)C2=C3C=CC(=[N+](CC)CC)C=C3OC4=C2C=CC(=C4)N(CC)CC)S(=O)(=O)[O-])OC(=O)CCCCCCCCCCCCCCC |
| InChIKey | NHMNXIHGKOHXQR-UHFFFAOYSA-N |
📖 Product Overview
Nlrbs-dppc (CAS: 115044-45-6) is a chemical compound with molecular formula C64H102N3O14PS2 and molecular weight 1232.6 g/mol. Its IUPAC systematic name is 2-[3-(diethylamino)-6-diethylazaniumylidenexanthen-9-yl]-5-[2-[2,3-di(hexadecanoyloxy)propoxy-hydroxyphosphoryl]oxyethylsulfamoyl]benzenesulfonate.
NHMNXIHGKOHXQR-UHFFFAOYSA-N.
SMILES: CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCNS(=O)(=O)C1=CC(=C(C=C1)C2=C3C=CC(=[N+](CC)CC)C=C3OC4=C2C=CC(=C4)N(CC)CC)S(=O)(=O)[O-])OC(=O)CCCCCCCCCCCCCCC.
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