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Home > Fluorides > 1263284-19-0
1263284-19-0 | 4H-1,2,4-Triazole, 4-[(4-fluorophenyl)methyl]-3-methyl-5-(2R)-2-pyrrolidinyl-
CAS No: 1263284-19-0 Catalog No: AG000SMG MDL No:MFCD12924850
Product Description
Catalog Number:
AG000SMG
Chemical Name:
4H-1,2,4-Triazole, 4-[(4-fluorophenyl)methyl]-3-methyl-5-(2R)-2-pyrrolidinyl-
CAS Number:
1263284-19-0
Molecular Formula:
C14H17FN4
Molecular Weight:
260.3100
MDL Number:
MFCD12924850
IUPAC Name:
4-[(4-fluorophenyl)methyl]-3-methyl-5-[(2R)-pyrrolidin-2-yl]-1,2,4-triazole
InChI:
InChI=1S/C14H17FN4/c1-10-17-18-14(13-3-2-8-16-13)19(10)9-11-4-6-12(15)7-5-11/h4-7,13,16H,2-3,8-9H2,1H3/t13-/m1/s1
InChI Key:
LTSJLNLVIPSREO-CYBMUJFWSA-N
SMILES:
Fc1ccc(cc1)Cn1c(C)nnc1[C@H]1CCCN1
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
260.144g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.316g/mol
Monoisotopic Mass:
260.144g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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