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Home > Pyridines > 1246088-45-8
1246088-45-8 | tert-Butyl (1-pivaloyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-6-yl)carbamate
CAS No: 1246088-45-8 Catalog No: AG00HHPX MDL No:MFCD17171323
Product Description
Catalog Number:
AG00HHPX
Chemical Name:
tert-Butyl (1-pivaloyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazin-6-yl)carbamate
CAS Number:
1246088-45-8
Molecular Formula:
C17H25N3O4
Molecular Weight:
335.3981
MDL Number:
MFCD17171323
IUPAC Name:
tert-butyl N-[1-(2,2-dimethylpropanoyl)-2,3-dihydropyrido[2,3-b][1,4]oxazin-6-yl]carbamate
InChI:
InChI=1S/C17H25N3O4/c1-16(2,3)14(21)20-9-10-23-13-11(20)7-8-12(18-13)19-15(22)24-17(4,5)6/h7-8H,9-10H2,1-6H3,(H,18,19,22)
InChI Key:
ZOAOFCDWBPMAMN-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc2c(n1)OCCN2C(=O)C(C)(C)C
Properties
Complexity:
481
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.185g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
335.404g/mol
Monoisotopic Mass:
335.185g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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