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21035-26-7 | Urea, N-1H-benzimidazol-2-yl-N'-ethyl-
CAS No: 21035-26-7 Catalog No: AG002KQ9 MDL No:
Product Description
Catalog Number:
AG002KQ9
Chemical Name:
Urea, N-1H-benzimidazol-2-yl-N'-ethyl-
CAS Number:
21035-26-7
Molecular Formula:
C10H12N4O
Molecular Weight:
204.2285
IUPAC Name:
1-(1H-benzimidazol-2-yl)-3-ethylurea
InChI:
InChI=1S/C10H12N4O/c1-2-11-10(15)14-9-12-7-5-3-4-6-8(7)13-9/h3-6H,2H2,1H3,(H3,11,12,13,14,15)
InChI Key:
XEISFTZDRRYOFW-UHFFFAOYSA-N
SMILES:
CCNC(=O)Nc1nc2c([nH]1)cccc2
NSC Number:
241609
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.101g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
204.233g/mol
Monoisotopic Mass:
204.101g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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