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Z-Pro-Leu-OH

CAT: 0926-FP111541-01Size: 10 gDry Ice: NoHazardous: No
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CAT#:0926-FP111541-01Size:10 g
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CAS Number
1634-90-8
MDL Number
MFCD00063227
Smiles
CC (C) C[C@@H] (C (=O) O) NC (=O) [C@@H]1CCCN1C (=O) OCC2=CC=CC=C2
Molecular Formula
C19H26N2O5
Molecular Weight
362.42 g/mol
Controlled
No

Chemical Information

Z-Pro-leu-OH
CAS Number1634-90-8
PubChem CID2818243
IUPAC Name(2S)-4-methyl-2-[[(2S)-1-phenylmethoxycarbonylpyrrolidine-2-carbonyl]amino]pentanoic acid
Molecular FormulaC19H26N2O5
Molecular Weight362.4
XLogP1.8
Topological Polar Surface Area95.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count26
Formal Charge0
Complexity502
SMILES
CC(C)C[C@@H](C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C19H26N2O5/c1-13(2)11-15(18(23)24)20-17(22)16-9-6-10-21(16)19(25)26-12-14-7-4-3-5-8-14/h3-5,7-8,13,15-16H,6,9-12H2,1-2H3,(H,20,22)(H,23,24)/t15-,16-/m0/s1
InChIKey
YCYXUKRYYSXSLJ-HOTGVXAUSA-N
Chemical Structure
2D Structure
2D structure of Z-Pro-leu-OH
CAS: 1634-90-8
CID: 2818243
Formula: C19H26N2O5
MW: 362.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight362.4
XLogP31.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass362.18417193
Monoisotopic Mass362.18417193
Topological Polar Surface Area95.9 Ų
Heavy Atom Count26
Formal Charge0
Complexity502
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes