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89259-39-2 | Methanimidamide, N-(1-methylethyl)-N'-[4-(2-methyl-4-thiazolyl)phenyl]-
CAS No: 89259-39-2 Catalog No: AG0041R8 MDL No:
Product Description
Catalog Number:
AG0041R8
Chemical Name:
Methanimidamide, N-(1-methylethyl)-N'-[4-(2-methyl-4-thiazolyl)phenyl]-
CAS Number:
89259-39-2
Molecular Formula:
C14H17N3S
Molecular Weight:
259.3699
IUPAC Name:
N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-N'-propan-2-ylmethanimidamide
InChI:
InChI=1S/C14H17N3S/c1-10(2)15-9-16-13-6-4-12(5-7-13)14-8-18-11(3)17-14/h4-10H,1-3H3,(H,15,16)
InChI Key:
WWXMOMQORDJQCS-UHFFFAOYSA-N
SMILES:
CC(NC=Nc1ccc(cc1)c1csc(n1)C)C
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.114g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
259.371g/mol
Monoisotopic Mass:
259.114g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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