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2060026-55-1 | tert-butyl N-{5H,6H,7H,8H-imidazo[1,2-a]pyrimidin-6-yl}carbamate
CAS No: 2060026-55-1 Catalog No: AG01B79I MDL No:MFCD30497526
Product Description
Catalog Number:
AG01B79I
Chemical Name:
tert-butyl N-{5H,6H,7H,8H-imidazo[1,2-a]pyrimidin-6-yl}carbamate
CAS Number:
2060026-55-1
Molecular Formula:
C11H18N4O2
Molecular Weight:
238.2862
MDL Number:
MFCD30497526
IUPAC Name:
tert-butyl N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidin-6-yl)carbamate
InChI:
InChI=1S/C11H18N4O2/c1-11(2,3)17-10(16)14-8-6-13-9-12-4-5-15(9)7-8/h4-5,8H,6-7H2,1-3H3,(H,12,13)(H,14,16)
InChI Key:
BVSVVYZTILAZNT-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CNc2n(C1)ccn2
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.143g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
238.291g/mol
Monoisotopic Mass:
238.143g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
68.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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