200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 1053071-55-8
1053071-55-8 | 2-(octahydro-1H-indol-2-yl)-1H-1,3-benzodiazole, Mixture of diastereomers
CAS No: 1053071-55-8 Catalog No: AG01AA6K MDL No:MFCD09807670
Product Description
Catalog Number:
AG01AA6K
Chemical Name:
2-(octahydro-1H-indol-2-yl)-1H-1,3-benzodiazole, Mixture of diastereomers
CAS Number:
1053071-55-8
Molecular Formula:
C15H19N3
Molecular Weight:
241.3315
MDL Number:
MFCD09807670
IUPAC Name:
2-(2,3,3a,4,5,6,7,7a-octahydro-1H-indol-2-yl)-1H-benzimidazole
InChI:
InChI=1S/C15H19N3/c1-2-6-11-10(5-1)9-14(16-11)15-17-12-7-3-4-8-13(12)18-15/h3-4,7-8,10-11,14,16H,1-2,5-6,9H2,(H,17,18)
InChI Key:
FTUQXJHPJLCOIY-UHFFFAOYSA-N
SMILES:
C1CCC2C(C1)NC(C2)c1nc2c([nH]1)cccc2
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.158g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
241.338g/mol
Monoisotopic Mass:
241.158g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.