Home Other Building Blocks 6-(1-cyclopropyl-5-fluoro-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-methylcyclohexa-2,4-dien-1-imine

6-(1-cyclopropyl-5-fluoro-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-methylcyclohexa-2,4-dien-1-imine

CAS No.:
1355936-44-5
Catalog Number:
AG01AL0D
Molecular Formula:
C17H16FN3
Molecular Weight:
281.3274
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Product Description
Catalog Number:
AG01AL0D
Chemical Name:
6-(1-cyclopropyl-5-fluoro-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-2-methylcyclohexa-2,4-dien-1-imine
CAS Number:
1355936-44-5
Molecular Formula:
C17H16FN3
Molecular Weight:
281.3274
MDL Number:
MFCD28155331
IUPAC Name:
2-(1-cyclopropyl-5-fluorobenzimidazol-2-yl)-6-methylaniline
InChI:
InChI=1S/C17H16FN3/c1-10-3-2-4-13(16(10)19)17-20-14-9-11(18)5-8-15(14)21(17)12-6-7-12/h2-5,8-9,12H,6-7,19H2,1H3
InChI Key:
DVSLIFVISXXOEW-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)[nH]c(=C1C=CC=C(C1=N)C)n2C1CC1
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.133g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
281.334g/mol
Monoisotopic Mass:
281.133g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties