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89250-30-6 | Benzenamine, 4-[2-(1-piperidinylmethyl)-4-thiazolyl]-
CAS No: 89250-30-6 Catalog No: AG0043RH MDL No:
Product Description
Catalog Number:
AG0043RH
Chemical Name:
Benzenamine, 4-[2-(1-piperidinylmethyl)-4-thiazolyl]-
CAS Number:
89250-30-6
Molecular Formula:
C15H19N3S
Molecular Weight:
273.3965
IUPAC Name:
4-[2-(piperidin-1-ylmethyl)-1,3-thiazol-4-yl]aniline
InChI:
InChI=1S/C15H19N3S/c16-13-6-4-12(5-7-13)14-11-19-15(17-14)10-18-8-2-1-3-9-18/h4-7,11H,1-3,8-10,16H2
InChI Key:
BPKOVYZPYPJERF-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1csc(n1)CN1CCCCC1
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.13g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.398g/mol
Monoisotopic Mass:
273.13g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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