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1183883-52-4 | 1-[(dimethyl-1,3-oxazol-2-yl)methyl]-1,4-diazepane
CAS No: 1183883-52-4 Catalog No: AG01ABB7 MDL No:MFCD12814189
Product Description
Catalog Number:
AG01ABB7
Chemical Name:
1-[(dimethyl-1,3-oxazol-2-yl)methyl]-1,4-diazepane
CAS Number:
1183883-52-4
Molecular Formula:
C11H19N3O
Molecular Weight:
209.2881
MDL Number:
MFCD12814189
IUPAC Name:
2-(1,4-diazepan-1-ylmethyl)-4,5-dimethyl-1,3-oxazole
InChI:
InChI=1S/C11H19N3O/c1-9-10(2)15-11(13-9)8-14-6-3-4-12-5-7-14/h12H,3-8H2,1-2H3
InChI Key:
IMGDFWRPFCHFBW-UHFFFAOYSA-N
SMILES:
Cc1oc(nc1C)CN1CCNCCC1
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.153g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.293g/mol
Monoisotopic Mass:
209.153g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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