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89446-82-2

89446-82-2 | 1H-Imidazole, 4,5-dihydro-4-phenyl-2-[[2-(1-pyrrolidinyl)ethyl]thio]-

CAS No: 89446-82-2 Catalog No: AG0044EZ MDL No:

Product Description

Catalog Number:
AG0044EZ
Chemical Name:
1H-Imidazole, 4,5-dihydro-4-phenyl-2-[[2-(1-pyrrolidinyl)ethyl]thio]-
CAS Number:
89446-82-2
Molecular Formula:
C15H21N3S
Molecular Weight:
275.4123
IUPAC Name:
5-phenyl-2-(2-pyrrolidin-1-ylethylsulfanyl)-4,5-dihydro-1H-imidazole
InChI:
InChI=1S/C15H21N3S/c1-2-6-13(7-3-1)14-12-16-15(17-14)19-11-10-18-8-4-5-9-18/h1-3,6-7,14H,4-5,8-12H2,(H,16,17)
InChI Key:
IIUAYOKEELZZEC-UHFFFAOYSA-N
SMILES:
C1CCN(C1)CCSC1=NC(CN1)c1ccccc1

Properties

Complexity:
307  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.146g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
275.414g/mol
Monoisotopic Mass:
275.146g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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