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303162-47-2 | 2-Pyridinamine, 4-[4-(3-methylphenyl)-2-propyl-5-thiazolyl]-
CAS No: 303162-47-2 Catalog No: AG002ZPB MDL No:
Product Description
Catalog Number:
AG002ZPB
Chemical Name:
2-Pyridinamine, 4-[4-(3-methylphenyl)-2-propyl-5-thiazolyl]-
CAS Number:
303162-47-2
Molecular Formula:
C18H19N3S
Molecular Weight:
309.4286
IUPAC Name:
4-[4-(3-methylphenyl)-2-propyl-1,3-thiazol-5-yl]pyridin-2-amine
InChI:
InChI=1S/C18H19N3S/c1-3-5-16-21-17(13-7-4-6-12(2)10-13)18(22-16)14-8-9-20-15(19)11-14/h4,6-11H,3,5H2,1-2H3,(H2,19,20)
InChI Key:
LNXNHTDOLUEEHG-UHFFFAOYSA-N
SMILES:
CCCc1sc(c(n1)c1cccc(c1)C)c1ccnc(c1)N
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.13g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
309.431g/mol
Monoisotopic Mass:
309.13g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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