Home Carbonyls (3S)-3-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]-5-methylhexanoic acid

(3S)-3-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]-5-methylhexanoic acid

CAS No.:
1308334-66-8
Catalog Number:
AG01BK5W
Molecular Formula:
C23H27NO4
Molecular Weight:
381.4648
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Product Description
Catalog Number:
AG01BK5W
Chemical Name:
(3S)-3-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]-5-methylhexanoic acid
CAS Number:
1308334-66-8
Molecular Formula:
C23H27NO4
Molecular Weight:
381.4648
MDL Number:
MFCD21247144
IUPAC Name:
(3S)-3-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]-5-methylhexanoic acid
InChI:
InChI=1S/C23H27NO4/c1-15(2)11-16(12-22(25)26)13-24-23(27)28-14-21-19-9-5-3-7-17(19)18-8-4-6-10-20(18)21/h3-10,15-16,21H,11-14H2,1-2H3,(H,24,27)(H,25,26)/t16-/m0/s1
InChI Key:
QSNYPRXHBQZYBM-INIZCTEOSA-N
SMILES:
CC(C[C@@H](CC(=O)O)CNC(=O)OCC1c2ccccc2c2c1cccc2)C
Properties
Complexity:
513  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
381.194g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
381.472g/mol
Monoisotopic Mass:
381.194g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Properties