Home Carbonyls 1,3-Di[N-Boc-4-(methoxycarbonyl)-4-piperidyl]urea

1,3-Di[N-Boc-4-(methoxycarbonyl)-4-piperidyl]urea

CAS No.:
1456821-62-7
Catalog Number:
AG001DA7
Molecular Formula:
C25H42N4O9
Molecular Weight:
542.6224
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Product Description
Catalog Number:
AG001DA7
Chemical Name:
1,3-Di[N-Boc-4-(methoxycarbonyl)-4-piperidyl]urea
CAS Number:
1456821-62-7
Molecular Formula:
C25H42N4O9
Molecular Weight:
542.6224
MDL Number:
MFCD26383910
IUPAC Name:
1-O-tert-butyl 4-O-methyl 4-[[4-methoxycarbonyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]carbamoylamino]piperidine-1,4-dicarboxylate
InChI:
InChI=1S/C25H42N4O9/c1-22(2,3)37-20(33)28-13-9-24(10-14-28,17(30)35-7)26-19(32)27-25(18(31)36-8)11-15-29(16-12-25)21(34)38-23(4,5)6/h9-16H2,1-8H3,(H2,26,27,32)
InChI Key:
GOTZPPVFQRKPQA-UHFFFAOYSA-N
SMILES:
COC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)NC(=O)NC1(CCN(CC1)C(=O)OC(C)(C)C)C(=O)OC
Properties
Complexity:
835  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
542.295g/mol
Formal Charge:
0
Heavy Atom Count:
38  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
542.63g/mol
Monoisotopic Mass:
542.295g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
153A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties