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1251578-66-1 | 4-Methyl-N-((tetrahydrofuran-2-yl)methyl)benzo[d]thiazol-2-amine
CAS No: 1251578-66-1 Catalog No: AG01FLRU MDL No:MFCD22204917
Product Description
Catalog Number:
AG01FLRU
Chemical Name:
4-Methyl-N-((tetrahydrofuran-2-yl)methyl)benzo[d]thiazol-2-amine
CAS Number:
1251578-66-1
Molecular Formula:
C13H16N2OS
Molecular Weight:
248.3439
MDL Number:
MFCD22204917
IUPAC Name:
4-methyl-N-(oxolan-2-ylmethyl)-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C13H16N2OS/c1-9-4-2-6-11-12(9)15-13(17-11)14-8-10-5-3-7-16-10/h2,4,6,10H,3,5,7-8H2,1H3,(H,14,15)
InChI Key:
HACWVPLXDPQELG-UHFFFAOYSA-N
SMILES:
Cc1cccc2c1nc(s2)NCC1CCCO1
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.098g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.344g/mol
Monoisotopic Mass:
248.098g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
62.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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