Home Carbonyls Butanoic acid, 3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-(phenylthio)-, (3R)-

Butanoic acid, 3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-(phenylthio)-, (3R)-

CAS No.:
1244724-97-7
Catalog Number:
AG000M1Q
Molecular Formula:
C25H23NO4S
Molecular Weight:
433.5194
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Product Description
Catalog Number:
AG000M1Q
Chemical Name:
Butanoic acid, 3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-(phenylthio)-, (3R)-
CAS Number:
1244724-97-7
Molecular Formula:
C25H23NO4S
Molecular Weight:
433.5194
IUPAC Name:
(3R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-phenylsulfanylbutanoic acid
InChI:
InChI=1S/C25H23NO4S/c27-24(28)14-17(16-31-18-8-2-1-3-9-18)26-25(29)30-15-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,17,23H,14-16H2,(H,26,29)(H,27,28)/t17-/m1/s1
InChI Key:
ZXVKPJJQNJPHQT-QGZVFWFLSA-N
SMILES:
OC(=O)C[C@@H](NC(=O)OCC1c2ccccc2c2c1cccc2)CSc1ccccc1
Properties
Complexity:
586  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
433.135g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
433.522g/mol
Monoisotopic Mass:
433.135g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  
Properties