Home Carboxys tert-butyl 2,3-diphenylpiperazine-1-carboxylate

tert-butyl 2,3-diphenylpiperazine-1-carboxylate

CAS No.:
886780-65-0
Catalog Number:
AG00H47W
Molecular Formula:
C21H26N2O2
Molecular Weight:
338.4433
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Product Description
Catalog Number:
AG00H47W
Chemical Name:
tert-butyl 2,3-diphenylpiperazine-1-carboxylate
CAS Number:
886780-65-0
Molecular Formula:
C21H26N2O2
Molecular Weight:
338.4433
MDL Number:
MFCD06660371
IUPAC Name:
tert-butyl 2,3-diphenylpiperazine-1-carboxylate
InChI:
InChI=1S/C21H26N2O2/c1-21(2,3)25-20(24)23-15-14-22-18(16-10-6-4-7-11-16)19(23)17-12-8-5-9-13-17/h4-13,18-19,22H,14-15H2,1-3H3
InChI Key:
AYXUZUABTMGOKA-UHFFFAOYSA-N
SMILES:
O=C(N1CCNC(C1c1ccccc1)c1ccccc1)OC(C)(C)C
Properties
Complexity:
434  
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:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
338.451g/mol
Monoisotopic Mass:
338.199g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties