200,000+ products from a single source!
sales@angenechem.com
1260859-36-6 | 1H-Pyrrolo[2,3-b]pyridine-1-carboxylic acid, 3-(aminomethyl)-, 1,1-dimethylethyl ester
CAS No: 1260859-36-6 Catalog No: AG000RH3 MDL No:MFCD13193500
Product Description
Catalog Number:
AG000RH3
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-1-carboxylic acid, 3-(aminomethyl)-, 1,1-dimethylethyl ester
CAS Number:
1260859-36-6
Molecular Formula:
C13H17N3O2
Molecular Weight:
247.2930
MDL Number:
MFCD13193500
IUPAC Name:
tert-butyl 3-(aminomethyl)pyrrolo[2,3-b]pyridine-1-carboxylate
InChI:
InChI=1S/C13H17N3O2/c1-13(2,3)18-12(17)16-8-9(7-14)10-5-4-6-15-11(10)16/h4-6,8H,7,14H2,1-3H3
InChI Key:
OJSDFEXIAAQNQI-UHFFFAOYSA-N
SMILES:
NCc1cn(c2c1cccn2)C(=O)OC(C)(C)C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.132g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.298g/mol
Monoisotopic Mass:
247.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.