Chemical structure of CAS 2365172-42-3

(2S,4R)-1-[(2S)-2-[[7-[4-[(3R)-3-[4-[[4-[4-[[2-(4-chlorophenyl)-5,5-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]benzoyl]sulfamoyl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperazin-1-yl]-7-oxoheptanoyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide

CAS No.	2365172-42-3
MDL No.	N/A
MF	C₇₇H₉₆ClF₃N₁₀O₁₀S₄
MW	1542.40
InChI Key	PXVFFBGSTYQHRO-REQIQPEASA-N

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Product Information

CAS No.	2365172-42-3
Product Name	(2S,4R)-1-[(2S)-2-[[7-[4-[(3R)-3-[4-[[4-[4-[[2-(4-chlorophenyl)-5,5-dimethylcyclohexen-1-yl]methyl]piperazin-1-yl]benzoyl]sulfamoyl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperazin-1-yl]-7-oxoheptanoyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide

Heavy Atom Count	105	Rotatable Bond Count	28
Atom Stereo Count	5	Bond Stereo Count	0
HBA	17	HBD	5
TPSA	251.070 Å²	Charge	0
Exact Mass	1540.58344	Complexity	4298.96
pKa	7.130	XLogP	12.398