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144317-23-7 | L-Glutamine, N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-[(4-methylphenyl)diphenylmethyl]-
CAS No: 144317-23-7 Catalog No: AG001JBR MDL No:MFCD00237163
Product Description
Catalog Number:
AG001JBR
Chemical Name:
L-Glutamine, N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-[(4-methylphenyl)diphenylmethyl]-
CAS Number:
144317-23-7
Molecular Formula:
C40H36N2O5
Molecular Weight:
624.7242
MDL Number:
MFCD00237163
IUPAC Name:
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-5-[[(4-methylphenyl)-diphenylmethyl]amino]-5-oxopentanoic acid
InChI:
InChI=1S/C40H36N2O5/c1-27-20-22-30(23-21-27)40(28-12-4-2-5-13-28,29-14-6-3-7-15-29)42-37(43)25-24-36(38(44)45)41-39(46)47-26-35-33-18-10-8-16-31(33)32-17-9-11-19-34(32)35/h2-23,35-36H,24-26H2,1H3,(H,41,46)(H,42,43)(H,44,45)/t36-/m0/s1
InChI Key:
XQIMEYIDZSICTF-BHVANESWSA-N
SMILES:
NC(=O)CC[C@H](N(C(c1ccc(cc1)C)(c1ccccc1)c1ccccc1)C(=O)OCC1c2ccccc2c2c1cccc2)C(=O)O
Properties
Complexity:
1000
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
624.262g/mol
Formal Charge:
0
Heavy Atom Count:
47
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
624.737g/mol
Monoisotopic Mass:
624.262g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.3
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