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88743-98-0 | L-Leucine, N-[N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-leucyl]-
CAS No: 88743-98-0 Catalog No: AG004E0Y MDL No:MFCD01632054
Product Description
Catalog Number:
AG004E0Y
Chemical Name:
L-Leucine, N-[N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-leucyl]-
CAS Number:
88743-98-0
Molecular Formula:
C27H34N2O5
Molecular Weight:
466.5693
MDL Number:
MFCD01632054
IUPAC Name:
(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-methylpentanoyl]amino]-4-methylpentanoic acid
InChI:
InChI=1S/C27H34N2O5/c1-16(2)13-23(25(30)28-24(26(31)32)14-17(3)4)29-27(33)34-15-22-20-11-7-5-9-18(20)19-10-6-8-12-21(19)22/h5-12,16-17,22-24H,13-15H2,1-4H3,(H,28,30)(H,29,33)(H,31,32)/t23-,24-/m0/s1
InChI Key:
OLBBXRXTYWLDPL-ZEQRLZLVSA-N
SMILES:
CC(C[C@@H](C(=O)N[C@H](C(=O)O)CC(C)C)NC(=O)OCC1c2ccccc2c2c1cccc2)C
Properties
Complexity:
687
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
466.247g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
466.578g/mol
Monoisotopic Mass:
466.247g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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