(4R)-N-tert-butyl-3-[(2S,3S)-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide

Modify Date: 2025-09-27 12:01:35

(4R)-N-tert-butyl-3-[(2S,3S)-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide structure	Common Name	(4R)-N-tert-butyl-3-[(2S,3S)-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide
	CAS Number	189357-33-3	Molecular Weight	555.72900
	Density	1.181g/cm3	Boiling Point	829.6ºC at 760mmHg
	Molecular Formula	C₃₀H₄₁N₃O₅S	Melting Point	N/A
	MSDS	N/A	Flash Point	455.6ºC

Name	(4R)-N-tert-butyl-3-[(2S,3S)-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide

Density	1.181g/cm3
Boiling Point	829.6ºC at 760mmHg
Molecular Formula	C₃₀H₄₁N₃O₅S
Molecular Weight	555.72900
Flash Point	455.6ºC
Exact Mass	555.27700
PSA	140.25000
LogP	4.98390
Vapour Pressure	3.61E-29mmHg at 25°C
Index of Refraction	1.571
InChIKey	CSWRAOHDICNMPU-LLZJGCNPSA-N
SMILES	Cc1cccc(C)c1OCC(=O)NC(Cc1ccccc1)C(O)C(=O)N1CSC(C)(C)C1C(=O)NC(C)(C)C

Name: Solubility
Source: ChEMBL
Target: N/A
External Id: CHEMBL875031

Name: HIV Enzyme Data
Source: NIAID
Target: N/A
External Id: HIV Enzyme Data

Name: Inhibition of HIV1 recombinant protease at 50 nM after 15 mins by fluorescence assay
Source: ChEMBL
Target: Protease
External Id: CHEMBL1037774

Name: T max was determined
Source: ChEMBL
Target: N/A
External Id: CHEMBL642681

Name: Water solubility by RP-HPLC
Source: ChEMBL
Target: N/A
External Id: CHEMBL628740

Name: HIV Cellular Data
Source: NIAID
Target: N/A
External Id: HIV Cellular Data

Name: Ratio of EC50 for HIV1 3B infected in human MT4 cells in presence of 50% human serum ...
Source: ChEMBL
Target: Human immunodeficiency virus 1
External Id: CHEMBL1037781

Name: Antiviral activity against HIV1 3B infected in human MT4 cells assessed as inhibition...
Source: ChEMBL
Target: Human immunodeficiency virus 1
External Id: CHEMBL1037779

Name: Antiviral activity against HIV1 3B infected in human MT4 cells assessed as inhibition...
Source: ChEMBL
Target: Human immunodeficiency virus 1
External Id: CHEMBL1037777

Name: Bioavailability
Source: ChEMBL
Target: N/A
External Id: CHEMBL639729

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(4R)-N-tert-butyl-3-[(2S,3S)-3-[[2-(2,6-dimethylphenoxy)acetyl]amino]-2-hydroxy-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide

Names

Chemical & Physical Properties

Synthetic Route

Bioassay

The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.