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154121-70-7 | H-Tyr-L-1,2,3,4-tetrahydroisoquinoline-3-carboxamide . HCl
CAS No: 154121-70-7 Catalog No: AG00ACJC MDL No:
Product Description
Catalog Number:
AG00ACJC
Chemical Name:
H-Tyr-L-1,2,3,4-tetrahydroisoquinoline-3-carboxamide . HCl
CAS Number:
154121-70-7
IUPAC Name:
(3S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
InChI:
InChI=1S/C19H21N3O3/c20-16(9-12-5-7-15(23)8-6-12)19(25)22-11-14-4-2-1-3-13(14)10-17(22)18(21)24/h1-8,16-17,23H,9-11,20H2,(H2,21,24)/t16-,17-/m0/s1
InChI Key:
KIHQBNDANGJYBJ-IRXDYDNUSA-N
Properties
Complexity:
490
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
339.158g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
339.395g/mol
Monoisotopic Mass:
339.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Human PEPT1 pharmacophore distinguishes between dipeptide transport and binding. | Journal of medicinal chemistry 20060615 |
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