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Home > Pyridines > 736964-73-1
736964-73-1 | 2-Phenylimino-3-pyridin-4-ylmethyl-thiazolidin-4-one
CAS No: 736964-73-1 Catalog No: AG016K8M MDL No:
Product Description
Catalog Number:
AG016K8M
Chemical Name:
2-Phenylimino-3-pyridin-4-ylmethyl-thiazolidin-4-one
CAS Number:
736964-73-1
Molecular Formula:
C15H13N3OS
Molecular Weight:
283.3482
IUPAC Name:
2-phenylimino-3-(pyridin-4-ylmethyl)-1,3-thiazolidin-4-one
InChI:
InChI=1S/C15H13N3OS/c19-14-11-20-15(17-13-4-2-1-3-5-13)18(14)10-12-6-8-16-9-7-12/h1-9H,10-11H2
InChI Key:
VGVDHVBMCRIYKG-UHFFFAOYSA-N
SMILES:
O=C1CS/C(=N/c2ccccc2)/N1Cc1ccncc1
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.078g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.349g/mol
Monoisotopic Mass:
283.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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