Catalog Number |
ACM83783771-1 |
CAS |
83783-77-1 |
Structure |
![{[CurrentData.Name]}](https://resource.alfa-chemistry.com/structure/83783-77-1.gif) |
IUPAC Name |
3-(dibenzylamino)azepan-2-one |
Synonyms |
3-(Dibenzylamino)azepan-2-one;83783-77-1;3-[BIS(BENZYL)AMINO]HEXAHYDRO-2H-AZEPIN-2-ONE;3-(Bis(benzyl)amino)hexahydro-2H-azepin-2-one;EINECS 280-811-6;SCHEMBL22469461;DTXSID901003834;AM807911;3-[bis-(Benzyl)amino]hexahydro-2H-azepin-2-one;3-[Bis(phenylmethyl)amino]hexahydro-2H-azepin-2-one;6-(Dibenzylamino)-3,4,5,6-tetrahydro-2H-azepin-7-ol |
Molecular Weight |
308.4g/mol |
Molecular Formula |
C20H24N2O |
Canonical SMILES |
C1CCNC(=O)C(C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3 |
InChI |
InChI=1S/C20H24N2O/c23-20-19(13-7-8-14-21-20)22(15-17-9-3-1-4-10-17)16-18-11-5-2-6-12-18/h1-6,9-12,19H,7-8,13-16H2,(H,21,23) |
InChI Key |
BRAYCQJGMBISSA-UHFFFAOYSA-N |
Complexity |
339 |
Covalently-Bonded Unit Count |
1 |
EC Number |
280-811-6 |
Exact Mass |
308.188863393g/mol |
Heavy Atom Count |
23 |
Hydrogen Bond Acceptor Count |
2 |
Monoisotopic Mass |
308.188863393g/mol |
Rotatable Bond Count |
5 |
Topological Polar Surface Area |
32.3Ų |
X Log P3 |
3.5 |