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2984-70-5 | (5s)-5-(1h-indol-3-ylmethyl)-3-phenyl-2-thioxoimidazolidin-4-one
CAS No: 2984-70-5 Catalog No: AG007K44 MDL No:
Product Description
Catalog Number:
AG007K44
Chemical Name:
(5s)-5-(1h-indol-3-ylmethyl)-3-phenyl-2-thioxoimidazolidin-4-one
CAS Number:
2984-70-5
Molecular Formula:
C18H15N3OS
Molecular Weight:
321.3962
IUPAC Name:
ethyl-methoxy-phenylsulfanyl-sulfanylidene-λ5-phosphane
InChI:
InChI=1S/C9H13OPS2/c1-3-11(12,10-2)13-9-7-5-4-6-8-9/h4-8H,3H2,1-2H3
InChI Key:
BFHXKSJAKWIQQW-UHFFFAOYSA-N
SMILES:
S=C1N[C@H](C(=O)N1c1ccccc1)Cc1c[nH]c2c1cccc2
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.015g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.296g/mol
Monoisotopic Mass:
232.015g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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