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132149-55-4 | Glycinamide, L-prolyl-L-tyrosyl- (9CI)
CAS No: 132149-55-4 Catalog No: AG0010A1 MDL No:
Product Description
Catalog Number:
AG0010A1
Chemical Name:
Glycinamide, L-prolyl-L-tyrosyl- (9CI)
CAS Number:
132149-55-4
Molecular Formula:
C16H22N4O4
Molecular Weight:
334.3703
IUPAC Name:
(2S)-N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]pyrrolidine-2-carboxamide
InChI:
InChI=1S/C16H22N4O4/c17-14(22)9-19-15(23)13(8-10-3-5-11(21)6-4-10)20-16(24)12-2-1-7-18-12/h3-6,12-13,18,21H,1-2,7-9H2,(H2,17,22)(H,19,23)(H,20,24)/t12-,13-/m0/s1
InChI Key:
RROWGLVTQPWNAI-STQMWFEESA-N
SMILES:
NC(=O)CNC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@@H]1CCCN1
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
334.164g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
334.376g/mol
Monoisotopic Mass:
334.164g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4
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