Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

(4S)-3-[(2R,3R)-4-Chloro-3-(2,4-difluorophenyl)-3-hydroxy-2-methyl-1-oxobutyl]-4-(phenylmethyl)-2-oxazolidinone

Related Products

Hot Products

Name

(4S)-3-[(2R,3R)-4-Chloro-3-(2,4-difluorophenyl)-3-hydroxy-2-methyl-1-oxobutyl]-4-(phenylmethyl)-2-oxazolidinone

EINECS N/A
CAS No. 169218-76-2 Density 1.387 g/cm3
PSA 66.84000 LogP 3.55530
Solubility N/A Melting Point N/A
Formula C21H20ClF2NO4 Boiling Point 589.906 °C at 760 mmHg
Molecular Weight 423.84 Flash Point 310.564 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 169218-76-2 ((S)-4-benzyl-3-((2R,3R)-4-chloro-3-(2,4-difluorophenyl)-3-hydroxy-2-methylbutanoyl)oxazolidin-2-one) Hazard Symbols N/A
Synonyms

(S)-4-benzyl-3-((2R,3R)-4-chloro-3-(2,4-difluorophenyl)-3-hydroxy-2-methylbutanoyl)oxazolidin-2-one;

Article Data 2

(4S)-3-[(2R,3R)-4-Chloro-3-(2,4-difluorophenyl)-3-hydroxy-2-methyl-1-oxobutyl]-4-(phenylmethyl)-2-oxazolidinone Specification

The (4S)-3-[(2R,3R)-4-Chloro-3-(2,4-difluorophenyl)-3-hydroxy-2-methyl-1-oxobutyl]-4-(phenylmethyl)-2-oxazolidinone, with the CAS number 169218-76-2, is also called (S)-4-benzyl-3-((2R,3R)-4-chloro-3-(2,4-difluorophenyl)-3-hydroxy-2-methylbutanoyl)oxazolidin-2-one. The systematic name is (4S)-4-benzyl-3-[(2R,3R)-4-chloro-3-(2,4-difluorophenyl)-3-hydroxy-2-methylbutanoyl]-1,3-oxazolidin-2-one. Its molecular formula is C21H20ClF2NO4.

The properties of the (4S)-3-[(2R,3R)-4-Chloro-3-(2,4-difluorophenyl)-3-hydroxy-2-methyl-1-oxobutyl]-4-(phenylmethyl)-2-oxazolidinone are: (1)ACD/LogP: 3.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 93; (6)ACD/BCF (pH 7.4): 93; (7)ACD/KOC (pH 5.5): 891; (8)ACD/KOC (pH 7.4): 891; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 66.84 Å2; (13)Index of Refraction: 1.581; (14)Molar Refractivity: 101.798 cm3; (15)Molar Volume: 305.636 cm3; (16)Polarizability: 40.356×10-24cm3; (17)Surface Tension: 53.982 dyne/cm; (18)Enthalpy of Vaporization: 92.579 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(c(F)c1)[C@@](O)(CCl)[C@H](C(=O)N2C(=O)OC[C@@H]2Cc3ccccc3)C
(2)InChI: InChI=1/C21H20ClF2NO4/c1-13(21(28,12-22)17-8-7-15(23)10-18(17)24)19(26)25-16(11-29-20(25)27)9-14-5-3-2-4-6-14/h2-8,10,13,16,28H,9,11-12H2,1H3/t13-,16-,21+/m0/s1
(3)InChIKey: VWEREKJCRSAXPE-UYTHQXMGBB

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 169218-76-2