1,2-Bis(4-methoxyphenyl)-N,N,N',N'-tetramethylethane-1,2-diamine
PubChem CID: 596430
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| Compound Synonyms | 1,2-Bis(4-methoxyphenyl)-N,N,N',N'-tetramethylethane-1,2-diamine, NNAZNRWIPXYANE-UHFFFAOYSA-N, 1,2-bis(4-methoxy-phenyl)-N,N,N',N'-tetramethyl-ethane-1,2-diamine |
|---|---|
| Topological Polar Surface Area | 24.9 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 24.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 312.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1,2-bis(4-methoxyphenyl)-N,N,N',N'-tetramethylethane-1,2-diamine |
| Prediction Hob | 1.0 |
| Xlogp | 3.3 |
| Molecular Formula | C20H28N2O2 |
| Prediction Swissadme | 1.0 |
| Inchi Key | NNAZNRWIPXYANE-UHFFFAOYSA-N |
| Fcsp3 | 0.4 |
| Logs | -3.06 |
| Rotatable Bond Count | 7.0 |
| Logd | 2.891 |
| Compound Name | 1,2-Bis(4-methoxyphenyl)-N,N,N',N'-tetramethylethane-1,2-diamine |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 328.215 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 328.215 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 328.4 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.8634272 |
| Inchi | InChI=1S/C20H28N2O2/c1-21(2)19(15-7-11-17(23-5)12-8-15)20(22(3)4)16-9-13-18(24-6)14-10-16/h7-14,19-20H,1-6H3 |
| Smiles | CN(C)C(C1=CC=C(C=C1)OC)C(C2=CC=C(C=C2)OC)N(C)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Syzygium Aromaticum (Plant) Rel Props:Source_db:cmaup_ingredients