(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride

C75H60ClF15N14O23 — CID 158864802

IUPAC(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride
SMILESCO.COc1ccc(C(=O)C[C@@H](c2ccc(OC(F)(F)F)c(F)c2)c2ncccc2F)nc1[N+](=O)[O-].COc1ccc(C)nc1[N+](=O)[O-].COc1ccc(OC=O)nc1[N+](=O)[O-].Cc1ccc(O)c([N+](=O)[O-])n1.Cl.N[C@@H](c1ccc(OC(F)(F)F)c(F)c1)c1ncccc1F.O=C(C[C@@H](c1ccc(OC(F)(F)F)c(F)c1)c1ncccc1F)c1ccc(O)c([N+](=O)[O-])n1
InChIInChI=1S/C21H14F5N3O5.C20H12F5N3O5.C13H9F5N2O.C7H6N2O5.C7H8N2O3.C6H6N2O3.CH4O.ClH/c1-33-18-7-5-15(28-20(18)29(31)32)16(30)10-12(19-13(22)3-2-8-27-19)11-4-6-17(14(23)9-11)34-21(24,25)26;21-12-2-1-7-26-18(12)11(10-3-6-17(13(22)8-10)33-20(23,24)25)9-16(30)14-4-5-15(29)19(27-14)28(31)32;14-8-2-1-5-20-12(8)11(19)7-3-4-10(9(15)6-7)21-13(16,17)18;1-13-5-2-3-6(14-4-10)8-7(5)9(11)12;1-5-3-4-6(12-2)7(8-5)9(10)11;1-4-2-3-5(9)6(7-4)8(10)11;1-2;/h2-9,12H,10H2,1H3;1-8,11,29H,9H2;1-6,11H,19H2;2-4H,1H3;3-4H,1-2H3;2-3,9H,1H3;2H,1H3;1H/t12-;2*11-;;;;;/m000...../s1
InChIKeyRSUIZCFLFRPKKM-QMULQJFOSA-N
MW1845.80 g/mol
LogP15.83
Rot. Bonds25

About (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride

(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride (PubChem CID 158864802) has the molecular formula C75H60ClF15N14O23 and a molecular weight of 1845.80 g/mol. Its IUPAC name is (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride.

Molecular Properties

Compound Name(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride
PubChem CID158864802
Molecular FormulaC75H60ClF15N14O23
Molecular Weight1845.80 g/mol
Exact Mass1844.34
IUPAC Name(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride
SMILESCO.COc1ccc(C(=O)C[C@@H](c2ccc(OC(F)(F)F)c(F)c2)c2ncccc2F)nc1[N+](=O)[O-].COc1ccc(C)nc1[N+](=O)[O-].COc1ccc(OC=O)nc1[N+](=O)[O-].Cc1ccc(O)c([N+](=O)[O-])n1.Cl.N[C@@H](c1ccc(OC(F)(F)F)c(F)c1)c1ncccc1F.O=C(C[C@@H](c1ccc(OC(F)(F)F)c(F)c1)c1ncccc1F)c1ccc(O)c([N+](=O)[O-])n1
InChIInChI=1S/C21H14F5N3O5.C20H12F5N3O5.C13H9F5N2O.C7H6N2O5.C7H8N2O3.C6H6N2O3.CH4O.ClH/c1-33-18-7-5-15(28-20(18)29(31)32)16(30)10-12(19-13(22)3-2-8-27-19)11-4-6-17(14(23)9-11)34-21(24,25)26;21-12-2-1-7-26-18(12)11(10-3-6-17(13(22)8-10)33-20(23,24)25)9-16(30)14-4-5-15(29)19(27-14)28(31)32;14-8-2-1-5-20-12(8)11(19)7-3-4-10(9(15)6-7)21-13(16,17)18;1-13-5-2-3-6(14-4-10)8-7(5)9(11)12;1-5-3-4-6(12-2)7(8-5)9(10)11;1-4-2-3-5(9)6(7-4)8(10)11;1-2;/h2-9,12H,10H2,1H3;1-8,11,29H,9H2;1-6,11H,19H2;2-4H,1H3;3-4H,1-2H3;2-3,9H,1H3;2H,1H3;1H/t12-;2*11-;;;;;/m000...../s1
InChIKeyRSUIZCFLFRPKKM-QMULQJFOSA-N
XLogP15.83
TPSA521.35 Ų
H-Bond Donors4
H-Bond Acceptors32
Rotatable Bonds25
Heavy Atoms128
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001845.80
LogP ≤ 515.83
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(4-methoxy-5-nitro-2-pyridinyl)propan-1-one;2-[(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]propanoyl]-5-nitro-1H-pyridin-4-one;4-methoxy-2-methyl-5-nitropyridine;4-methoxy-2-methyl-1-oxidopyridin-1-ium;4-methoxy-2-methylpyridine;4-methoxy-5-nitropyridine-2-carboxylic acid;2-methyl-4-nitro-1-oxidopyridin-1-ium;2-methyl-1-oxidopyridin-1-ium
CID 158453885
2,5-dimethyl-4-nitro-1-oxidopyridin-1-ium;2,5-dimethyl-1-oxidopyridin-1-ium;2,5-dimethylpyridine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-4-nitro-2-pyridinyl)propan-1-one;methanol;5-methyl-4-nitropyridine-2-carbaldehyde;5-methyl-4-nitropyridine-2-carboxylic acid;(5-methyl-4-nitro-2-pyridinyl)methanol;6-methylpyridin-3-ol
CID 158552924
(3S)-1-(4-amino-5-methoxy-2-pyridinyl)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]propan-1-one;2,5-dimethyl-4-nitro-1-oxidopyridin-1-ium;2,5-dimethyl-1-oxidopyridin-1-ium;2,5-dimethylpyridine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-4-nitro-2-pyridinyl)propan-1-one;methanol;5-methyl-4-nitropyridine-2-carbaldehyde;5-methyl-4-nitropyridine-2-carboxylic acid;(5-methyl-4-nitro-2-pyridinyl)methanol;6-methylpyridin-3-ol
CID 159730816
(3S)-1-(6-amino-5-hydroxy-2-pyridinyl)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]propan-1-one;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride
CID 160360814
Tris(carbon dioxide);bis(2,3-dimethyl-6-propan-2-ylpyridine);4,5-dimethyl-2-propan-2-ylpyridine;3-fluoro-2-methyl-6-propan-2-ylpyridine;methane;2-methoxy-3-methyl-6-propan-2-ylpyridine;3-methoxy-2-methyl-6-propan-2-ylpyridine;3-methyl-6-propan-2-ylpyridin-2-amine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-2-carboxylic acid;5-methyl-2-propan-2-ylpyridine-4-carboxylic acid;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carboxylic acid;3-propan-2-yl-5-(trifluoromethyl)pyridine-2-carboxylic acid
CID 160925739
2,4-dimethyl-5-nitropyridine;2,4-dimethyl-1-oxidopyridin-1-ium;2,4-dimethylpyridine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(4-methoxy-5-nitro-2-pyridinyl)propan-1-one;2-[(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]propanoyl]-5-nitro-1H-pyridin-4-one;2-methyl-4-nitro-1-oxidopyridin-1-ium;4-methyl-5-nitropyridine-2-carboxylic acid;2-methyl-1-oxidopyridin-1-ium
CID 160974164
5-amino-2-[(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]propanoyl]-1H-pyridin-4-one;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(4-methoxy-5-nitro-2-pyridinyl)propan-1-one;2-[(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]propanoyl]-5-nitro-1H-pyridin-4-one;methane;4-methoxy-2-methyl-5-nitropyridine;4-methoxy-2-methyl-1-oxidopyridin-1-ium;4-methoxy-2-methylpyridine;4-methoxy-5-nitropyridine-2-carboxylic acid;2-methyl-4-nitro-1-oxidopyridin-1-ium;2-methyl-1-oxidopyridin-1-ium
CID 161228808
(3S)-1-(6-amino-5-hydroxy-2-pyridinyl)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]propan-1-one;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;5-[(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]propanoyl]-3H-[1,3]oxazolo[4,5-b]pyridin-2-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol
CID 162205751

Frequently Asked Questions

What is the IUPAC name of (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride?
The IUPAC name of (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride (CID 158864802) is (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride.
What is the SMILES notation for (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride?
The canonical SMILES for (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride is CO.COc1ccc(C(=O)C[C@@H](c2ccc(OC(F)(F)F)c(F)c2)c2ncccc2F)nc1[N+](=O)[O-].COc1ccc(C)nc1[N+](=O)[O-].COc1ccc(OC=O)nc1[N+](=O)[O-].Cc1ccc(O)c([N+](=O)[O-])n1.Cl.N[C@@H](c1ccc(OC(F)(F)F)c(F)c1)c1ncccc1F.O=C(C[C@@H](c1ccc(OC(F)(F)F)c(F)c1)c1ncccc1F)c1ccc(O)c([N+](=O)[O-])n1.
What is the InChIKey of (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride?
The InChIKey is RSUIZCFLFRPKKM-QMULQJFOSA-N. The full InChI is InChI=1S/C21H14F5N3O5.C20H12F5N3O5.C13H9F5N2O.C7H6N2O5.C7H8N2O3.C6H6N2O3.CH4O.ClH/c1-33-18-7-5-15(28-20(18)29(31)32)16(30)10-12(19-13(22)3-2-8-27-19)11-4-6-17(14(23)9-11)34-21(24,25)26;21-12-2-1-7-26-18(12)11(10-3-6-17(13(22)8-10)33-20(23,24)25)9-16(30)14-4-5-15(29)19(27-14)28(31)32;14-8-2-1-5-20-12(8)11(19)7-3-4-10(9(15)6-7)21-13(16,17)18;1-13-5-2-3-6(14-4-10)8-7(5)9(11)12;1-5-3-4-6(12-2)7(8-5)9(10)11;1-4-2-3-5(9)6(7-4)8(10)11;1-2;/h2-9,12H,10H2,1H3;1-8,11,29H,9H2;1-6,11H,19H2;2-4H,1H3;3-4H,1-2H3;2-3,9H,1H3;2H,1H3;1H/t12-;2*11-;;;;;/m000...../s1.
What are the key properties of (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride?
(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride has a molecular weight of 1845.80 g/mol, XLogP of 15.83, 25 rotatable bonds, 4 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-hydroxy-6-nitro-2-pyridinyl)propan-1-one;(S)-(3-fluoro-2-pyridinyl)-[3-fluoro-4-(trifluoromethoxy)phenyl]methanamine;(3S)-3-(3-fluoro-2-pyridinyl)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-1-(5-methoxy-6-nitro-2-pyridinyl)propan-1-one;methanol;3-methoxy-6-methyl-2-nitropyridine;(5-methoxy-6-nitro-2-pyridinyl) formate;6-methyl-2-nitropyridin-3-ol;hydrochloride is sourced from PubChem (CID 158864802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).