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101544-49-4 | 1H-Indole-7-carboxamide, 5-(2-amino-1-hydroxyethyl)-
CAS No: 101544-49-4 Catalog No: AG0004QV MDL No:
Product Description
Catalog Number:
AG0004QV
Chemical Name:
1H-Indole-7-carboxamide, 5-(2-amino-1-hydroxyethyl)-
CAS Number:
101544-49-4
Molecular Formula:
C11H13N3O2
Molecular Weight:
219.2398
IUPAC Name:
5-(2-amino-1-hydroxyethyl)-1H-indole-7-carboxamide
InChI:
InChI=1S/C11H13N3O2/c12-5-9(15)7-3-6-1-2-14-10(6)8(4-7)11(13)16/h1-4,9,14-15H,5,12H2,(H2,13,16)
InChI Key:
GHZFFYJKVKWIPM-UHFFFAOYSA-N
SMILES:
NCC(c1cc2cc[nH]c2c(c1)C(=O)N)O
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.101g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
219.244g/mol
Monoisotopic Mass:
219.101g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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