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2-{[(9H-fluoren-9-ylmethoxy)carbonyl](phenyl)amino}-3-sulfanylpropanoic acid

2-{[(9H-fluoren-9-ylmethoxy)carbonyl](phenyl)amino}-3-sulfanylpropanoic acid

Formula: C24H21NO4S

SMILES: OC(=O)C(CS)N(C(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C1=CC=CC=C1

IUPAC: 2-({[(9H-fluoren-9-yl)methoxy]carbonyl}(phenyl)amino)-3-sulfanylpropanoic acid

InChI: InChI=1/C24H21NO4S/c26-23(27)22(15-30)25(16-8-2-1-3-9-16)24(28)29-14-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-13,21-22,30H,14-15H2,(H,26,27)

Composition: C (68.72%), H (5.05%), N (3.34%), O (15.26%), S (7.64%)

Molar Mass: 419.5

Atom Count: 51

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 419.119129334
Formal Charge 0
FSP3 0.17
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey IFDDLMBAXOPSOH-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 116.98
Topological Polar Surface Area 66.84
Polarizability 46.64
Ring Count 4
Rotatable Bond Count 7

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Purity (%)
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Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C24H21NO4S Quote Only