Home Other Building Blocks benzyl N-[1-oxo-1-(3-oxopiperazin-1-yl)propan-2-yl]carbamate

benzyl N-[1-oxo-1-(3-oxopiperazin-1-yl)propan-2-yl]carbamate

CAS No.:
1214658-70-4
Catalog Number:
AG019XMR
Molecular Formula:
C15H19N3O4
Molecular Weight:
305.3291
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Product Description
Catalog Number:
AG019XMR
Chemical Name:
benzyl N-[1-oxo-1-(3-oxopiperazin-1-yl)propan-2-yl]carbamate
CAS Number:
1214658-70-4
Molecular Formula:
C15H19N3O4
Molecular Weight:
305.3291
MDL Number:
MFCD13196229
IUPAC Name:
benzyl N-[1-oxo-1-(3-oxopiperazin-1-yl)propan-2-yl]carbamate
InChI:
InChI=1S/C15H19N3O4/c1-11(14(20)18-8-7-16-13(19)9-18)17-15(21)22-10-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3,(H,16,19)(H,17,21)
InChI Key:
MRAXFRZZXXZOSZ-UHFFFAOYSA-N
SMILES:
O=C1NCCN(C1)C(=O)C(NC(=O)OCc1ccccc1)C
Properties
Complexity:
421  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.138g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
305.334g/mol
Monoisotopic Mass:
305.138g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties