5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol

C171H199Cl3F8N17O21P3S8 — CID 160673679

About 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol

5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol (PubChem CID 160673679) has the molecular formula C171H199Cl3F8N17O21P3S8 and a molecular weight of 3436.37 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol.

Molecular Properties

• Compound Name: 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol
• PubChem CID: 160673679
• Molecular Formula: C171H199Cl3F8N17O21P3S8
• Molecular Weight: 3436.37 g/mol
• Exact Mass: 3432.09
• IUPAC Name: 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol
• SMILES: Cc1c(C(=O)O)c(-c2cccc(N3CCN(c4ccc(N5CCO[P@@]5(=O)c5ccc(C[C@H](CCN6CCC(CO)CC6)CSc6ccccc6)c(S(C)(=O)=O)c5)cc4)CC3)c2)c(-c2ccc(Cl)cc2)n1C(C)C.Cc1c(S(C)(=O)=O)c(-c2cc(F)cc(N3CCN(c4ccc(N5CCCO[P@@]5(=O)c5ccc(N[C@H](CCN6CCC(CO)CC6)CSc6ccccc6)c(S(=O)(=O)C(F)(F)F)c5)cc4)CC3)c2)c(-c2ccc(Cl)cc2)n1C(C)C.Cc1c(S(C)(=O)=O)c(-c2cc(F)cc(N3CCN(c4ccc(N5CCCO[P@]5(=O)c5ccc(N[C@H](CCN6CCC(CO)CC6)CSc6ccccc6)c(S(=O)(=O)C(F)(F)F)c5)cc4)CC3)c2)c(-c2ccc(Cl)cc2)n1C(C)C
• InChI: InChI=1S/2C57H66ClF4N6O7PS3.C57H67ClN5O7PS2/c2*1-39(2)68-40(3)56(78(4,71)72)54(55(68)42-11-13-44(58)14-12-42)43-33-45(59)35-49(34-43)66-30-28-65(29-31-66)47-15-17-48(18-16-47)67-24-8-32-75-76(67,70)50-19-20-52(53(36-50)79(73,74)57(60,61)62)63-46(38-77-51-9-6-5-7-10-51)23-27-64-25-21-41(37-69)22-26-64;1-40(2)63-41(3)54(57(65)66)55(56(63)44-13-16-47(58)17-14-44)46-9-8-10-50(36-46)61-31-29-60(30-32-61)48-18-20-49(21-19-48)62-33-34-70-71(62,67)51-22-15-45(53(37-51)73(4,68)69)35-43(39-72-52-11-6-5-7-12-52)25-28-59-26-23-42(38-64)24-27-59/h2*5-7,9-20,33-36,39,41,46,63,69H,8,21-32,37-38H2,1-4H3;5-22,36-37,40,42-43,64H,23-35,38-39H2,1-4H3,(H,65,66)/t46-,76+;46-,76-;43-,71-/m110/s1
• InChIKey: RNGJBGOPHFEMBZ-IMVJSRSJSA-N
• XLogP: 35.07
• TPSA: 425.32 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 37
• Rotatable Bonds: 54
• Heavy Atoms: 231
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3436.37
LogP ≤ 5	35.07
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol?

The IUPAC name of 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol (CID 160673679) is 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol.

What is the SMILES notation for 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol?

The canonical SMILES for 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol is Cc1c(C(=O)O)c(-c2cccc(N3CCN(c4ccc(N5CCO[P@@]5(=O)c5ccc(C[C@H](CCN6CCC(CO)CC6)CSc6ccccc6)c(S(C)(=O)=O)c5)cc4)CC3)c2)c(-c2ccc(Cl)cc2)n1C(C)C.Cc1c(S(C)(=O)=O)c(-c2cc(F)cc(N3CCN(c4ccc(N5CCCO[P@@]5(=O)c5ccc(N[C@H](CCN6CCC(CO)CC6)CSc6ccccc6)c(S(=O)(=O)C(F)(F)F)c5)cc4)CC3)c2)c(-c2ccc(Cl)cc2)n1C(C)C.Cc1c(S(C)(=O)=O)c(-c2cc(F)cc(N3CCN(c4ccc(N5CCCO[P@]5(=O)c5ccc(N[C@H](CCN6CCC(CO)CC6)CSc6ccccc6)c(S(=O)(=O)C(F)(F)F)c5)cc4)CC3)c2)c(-c2ccc(Cl)cc2)n1C(C)C.

What is the InChIKey of 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol?

The InChIKey is RNGJBGOPHFEMBZ-IMVJSRSJSA-N. The full InChI is InChI=1S/2C57H66ClF4N6O7PS3.C57H67ClN5O7PS2/c2*1-39(2)68-40(3)56(78(4,71)72)54(55(68)42-11-13-44(58)14-12-42)43-33-45(59)35-49(34-43)66-30-28-65(29-31-66)47-15-17-48(18-16-47)67-24-8-32-75-76(67,70)50-19-20-52(53(36-50)79(73,74)57(60,61)62)63-46(38-77-51-9-6-5-7-10-51)23-27-64-25-21-41(37-69)22-26-64;1-40(2)63-41(3)54(57(65)66)55(56(63)44-13-16-47(58)17-14-44)46-9-8-10-50(36-46)61-31-29-60(30-32-61)48-18-20-49(21-19-48)62-33-34-70-71(62,67)51-22-15-45(53(37-51)73(4,68)69)35-43(39-72-52-11-6-5-7-12-52)25-28-59-26-23-42(38-64)24-27-59/h2*5-7,9-20,33-36,39,41,46,63,69H,8,21-32,37-38H2,1-4H3;5-22,36-37,40,42-43,64H,23-35,38-39H2,1-4H3,(H,65,66)/t46-,76+;46-,76-;43-,71-/m110/s1.

What are the key properties of 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol?

5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol has a molecular weight of 3436.37 g/mol, XLogP of 35.07, 54 rotatable bonds, 6 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(4-chlorophenyl)-4-[3-[4-[4-[(2S)-2-[4-[(2R)-4-[4-(hydroxymethyl)piperidin-1-yl]-2-(phenylsulfanylmethyl)butyl]-3-methylsulfonylphenyl]-2-oxo-1,3,2λ5-oxazaphospholidin-3-yl]phenyl]piperazin-1-yl]phenyl]-2-methyl-1-propan-2-ylpyrrole-3-carboxylic acid;[1-[(3R)-3-[4-[(2R)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol;[1-[(3R)-3-[4-[(2S)-3-[4-[4-[3-[2-(4-chlorophenyl)-5-methyl-4-methylsulfonyl-1-propan-2-ylpyrrol-3-yl]-5-fluorophenyl]piperazin-1-yl]phenyl]-2-oxo-1,3,2λ5-oxazaphosphinan-2-yl]-2-(trifluoromethylsulfonyl)anilino]-4-phenylsulfanylbutyl]piperidin-4-yl]methanol is sourced from PubChem (CID 160673679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).