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19249-88-8 | 3-benzoyl-1-(4-iodophenyl)thiourea
CAS No: 19249-88-8 Catalog No: AG00IWAH MDL No:MFCD00761155
Product Description
Catalog Number:
AG00IWAH
Chemical Name:
3-benzoyl-1-(4-iodophenyl)thiourea
CAS Number:
19249-88-8
Molecular Formula:
C14H11IN2OS
Molecular Weight:
382.2194
MDL Number:
MFCD00761155
IUPAC Name:
N-[(4-iodophenyl)carbamothioyl]benzamide
InChI:
InChI=1S/C14H11IN2OS/c15-11-6-8-12(9-7-11)16-14(19)17-13(18)10-4-2-1-3-5-10/h1-9H,(H2,16,17,18,19)
InChI Key:
IIDSDYPOUROQIA-UHFFFAOYSA-N
SMILES:
S=C(NC(=O)c1ccccc1)Nc1ccc(cc1)I
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.964g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
382.219g/mol
Monoisotopic Mass:
381.964g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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