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(4S)-3-[(2R,5S)-5-(4-fluorophenyl)-2-[(S)-[(4-fluorophenyl)amino](4-hydroxyphenyl)methyl]-5-hydroxypentanoyl]-4-phenyl-1,3-oxazolidin-2-one

(4S)-3-[(2R,5S)-5-(4-fluorophenyl)-2-[(S)-[(4-fluorophenyl)amino](4-hydroxyphenyl)methyl]-5-hydroxypentanoyl]-4-phenyl-1,3-oxazolidin-2-one

CAS: 1185883-40-2

Formula: C33H30F2N2O5

SMILES: O[C@@H](CC[C@H]([C@H](NC1=CC=C(F)C=C1)C1=CC=C(O)C=C1)C(=O)N1[C@H](COC1=O)C1=CC=CC=C1)C1=CC=C(F)C=C1

IUPAC: (4S)-3-[(2R,5S)-5-(4-fluorophenyl)-2-[(S)-[(4-fluorophenyl)amino](4-hydroxyphenyl)methyl]-5-hydroxypentanoyl]-4-phenyl-1,3-oxazolidin-2-one

InChI: InChI=1S/C33H30F2N2O5/c34-24-10-6-22(7-11-24)30(39)19-18-28(32(40)37-29(20-42-33(37)41)21-4-2-1-3-5-21)31(23-8-16-27(38)17-9-23)36-26-14-12-25(35)13-15-26/h1-17,28-31,36,38-39H,18-20H2/t28-,29-,30+,31-/m1/s1

Composition: C (69.22%), H (5.28%), F (6.64%), N (4.89%), O (13.97%)

Molar Mass: 572.609

Atom Count: 72

Heavy Atom Count: 42

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 4
Exact Mass 572.2122784
Formal Charge 0
FSP3 0.21
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 3
InChIKey WYMDQBFNYMAMNK-LTXXGDHTSA-N
Lipinski's Rule of Five
Molar Refractivity 153.94
Topological Polar Surface Area 99.1
Polarizability 58.63
Ring Count 5
Rotatable Bond Count 10

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Purity (%)
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Purity LeadTime CAS PacketSize UnitPrice
97% <14 Days 1185883-40-2 $138.72-$1,108.74$138.72$1,108.74
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