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19966-32-6 | Benzamide, N-[2-(phenylthio)ethyl]-
CAS No: 19966-32-6 Catalog No: AG002CA3 MDL No:
Product Description
Catalog Number:
AG002CA3
Chemical Name:
Benzamide, N-[2-(phenylthio)ethyl]-
CAS Number:
19966-32-6
Molecular Formula:
C15H15NOS
Molecular Weight:
257.3507
IUPAC Name:
N-(2-phenylsulfanylethyl)benzamide
InChI:
InChI=1S/C15H15NOS/c17-15(13-7-3-1-4-8-13)16-11-12-18-14-9-5-2-6-10-14/h1-10H,11-12H2,(H,16,17)
InChI Key:
DTZYZGPKFQRWFG-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)NCCSc1ccccc1
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.087g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
257.351g/mol
Monoisotopic Mass:
257.087g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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