200,000+ products from a single source!
sales@angenechem.com
119695-00-0 | Propanedioic acid, 2-amino-2-(1H-indol-3-ylmethyl)-, 1,3-diethyl ester
CAS No: 119695-00-0 Catalog No: AG000PG8 MDL No:
Product Description
Catalog Number:
AG000PG8
Chemical Name:
Propanedioic acid, 2-amino-2-(1H-indol-3-ylmethyl)-, 1,3-diethyl ester
CAS Number:
119695-00-0
Molecular Formula:
C16H20N2O4
Molecular Weight:
304.3410
IUPAC Name:
diethyl 2-amino-2-(1H-indol-3-ylmethyl)propanedioate
InChI:
InChI=1S/C16H20N2O4/c1-3-21-14(19)16(17,15(20)22-4-2)9-11-10-18-13-8-6-5-7-12(11)13/h5-8,10,18H,3-4,9,17H2,1-2H3
InChI Key:
KANUWVRMUOALHB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(=O)OCC)(Cc1c[nH]c2c1cccc2)N
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.142g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
304.346g/mol
Monoisotopic Mass:
304.142g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
94.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.