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1219844-34-4 | 6-Chloro-4-methyl-N-(pyridin-3-ylmethyl)benzo[d]thiazol-2-amine
CAS No: 1219844-34-4 Catalog No: AG01FLZ4 MDL No:MFCD16631665
Product Description
Catalog Number:
AG01FLZ4
Chemical Name:
6-Chloro-4-methyl-N-(pyridin-3-ylmethyl)benzo[d]thiazol-2-amine
CAS Number:
1219844-34-4
Molecular Formula:
C14H12ClN3S
Molecular Weight:
289.7832
MDL Number:
MFCD16631665
IUPAC Name:
6-chloro-4-methyl-N-(pyridin-3-ylmethyl)-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C14H12ClN3S/c1-9-5-11(15)6-12-13(9)18-14(19-12)17-8-10-3-2-4-16-7-10/h2-7H,8H2,1H3,(H,17,18)
InChI Key:
NBLVHWNPJDQFMV-UHFFFAOYSA-N
SMILES:
Clc1cc(C)c2c(c1)sc(n2)NCc1cccnc1
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.044g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.781g/mol
Monoisotopic Mass:
289.044g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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