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220364-78-3 | Methyl 1,4-Dibenzyl-1,4-diazepane-2-carboxylate
CAS No: 220364-78-3 Catalog No: AG01FLP2 MDL No:
Product Description
Catalog Number:
AG01FLP2
Chemical Name:
Methyl 1,4-Dibenzyl-1,4-diazepane-2-carboxylate
CAS Number:
220364-78-3
IUPAC Name:
methyl 1,4-dibenzyl-1,4-diazepane-2-carboxylate
InChI:
InChI=1S/C21H26N2O2/c1-25-21(24)20-17-22(15-18-9-4-2-5-10-18)13-8-14-23(20)16-19-11-6-3-7-12-19/h2-7,9-12,20H,8,13-17H2,1H3
InChI Key:
FPLKLNINPXCYAO-UHFFFAOYSA-N
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.199g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.451g/mol
Monoisotopic Mass:
338.199g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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