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64965-92-0 | Piperazine, 1-(2-naphthalenylmethyl)-4-(2-thiazolyl)-
CAS No: 64965-92-0 Catalog No: AG00H7JL MDL No:
Product Description
Catalog Number:
AG00H7JL
Chemical Name:
Piperazine, 1-(2-naphthalenylmethyl)-4-(2-thiazolyl)-
CAS Number:
64965-92-0
Molecular Formula:
C18H19N3S
Molecular Weight:
309.4286
IUPAC Name:
2-[4-(naphthalen-2-ylmethyl)piperazin-1-yl]-1,3-thiazole
InChI:
InChI=1S/C18H19N3S/c1-2-4-17-13-15(5-6-16(17)3-1)14-20-8-10-21(11-9-20)18-19-7-12-22-18/h1-7,12-13H,8-11,14H2
InChI Key:
CNHONDQAIRWONL-UHFFFAOYSA-N
SMILES:
c1csc(n1)N1CCN(CC1)Cc1ccc2c(c1)cccc2
Properties
Complexity:
356
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:
0
Isotope Atom Count:
0
Molecular Weight:
309.431g/mol
Monoisotopic Mass:
309.13g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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