Home Other Building Blocks N-[(1,3-benzothiazol-2-yl)methyl]cyclopropanamine

N-[(1,3-benzothiazol-2-yl)methyl]cyclopropanamine

CAS No.:
1182986-24-8
Catalog Number:
AG01BIZI
Molecular Formula:
C11H12N2S
Molecular Weight:
204.2914
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Product Description
Catalog Number:
AG01BIZI
Chemical Name:
N-[(1,3-benzothiazol-2-yl)methyl]cyclopropanamine
CAS Number:
1182986-24-8
Molecular Formula:
C11H12N2S
Molecular Weight:
204.2914
MDL Number:
MFCD12148549
IUPAC Name:
N-(1,3-benzothiazol-2-ylmethyl)cyclopropanamine
InChI:
InChI=1S/C11H12N2S/c1-2-4-10-9(3-1)13-11(14-10)7-12-8-5-6-8/h1-4,8,12H,5-7H2
InChI Key:
GCWLXPWZFXOBII-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)sc(n2)CNC1CC1
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.072g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.291g/mol
Monoisotopic Mass:
204.072g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties