2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol

C170H158ClN19O16S3 — CID 161339512

IUPAC2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol
SMILESC=C(O)[C@@H]1CCCN1.C=C(O)c1ccccn1.CC(C)(O)c1ccccn1.CN(C)c1ccccc1O.Cc1cc(-c2ccccc2)nn1-c1ccccn1.OC(c1ccc(Cl)cc1)c1ccccn1.OC(c1ccccc1)(c1ccccc1)[C@@H]1CCCN1.OCCc1ccccn1.Oc1cccc2cccnc12.Oc1ccccc1-c1ccccn1.Oc1ccccc1-c1cn2ccccc2n1.Oc1ccccc1-c1nc2ccccc2o1.Oc1ccccc1-c1nc2ccccc2s1.Oc1ccccc1-c1nc2sc(-c3ccccc3O)nc2s1.Oc1ccccc1/N=C/C=C/c1ccccc1
InChIInChI=1S/C17H19NO.C16H10N2O2S2.C15H13N3.C15H13NO.C13H10N2O.C13H9NO2.C13H9NOS.C12H10ClNO.C11H9NO.C9H7NO.2C8H11NO.C7H7NO.C7H9NO.C6H11NO/c19-17(16-12-7-13-18-16,14-8-3-1-4-9-14)15-10-5-2-6-11-15;19-11-7-3-1-5-9(11)13-17-15-16(21-13)18-14(22-15)10-6-2-4-8-12(10)20;1-12-11-14(13-7-3-2-4-8-13)17-18(12)15-9-5-6-10-16-15;17-15-11-5-4-10-14(15)16-12-6-9-13-7-2-1-3-8-13;16-12-6-2-1-5-10(12)11-9-15-8-4-3-7-13(15)14-11;2*15-11-7-3-1-5-9(11)13-14-10-6-2-4-8-12(10)16-13;13-10-6-4-9(5-7-10)12(15)11-3-1-2-8-14-11;13-11-7-2-1-5-9(11)10-6-3-4-8-12-10;11-8-5-1-3-7-4-2-6-10-9(7)8;1-9(2)7-5-3-4-6-8(7)10;1-8(2,10)7-5-3-4-6-9-7;1-6(9)7-4-2-3-5-8-7;9-6-4-7-3-1-2-5-8-7;1-5(8)6-3-2-4-7-6/h1-6,8-11,16,18-19H,7,12-13H2;1-8,19-20H;2-11H,1H3;1-12,17H;1-9,16H;2*1-8,15H;1-8,12,15H;1-8,13H;1-6,11H;2*3-6,10H,1-2H3;2-5,9H,1H2;1-3,5,9H,4,6H2;6-8H,1-4H2/b;;;9-6+,16-12+;;;;;;;;;;;/t16-;;;;;;;;;;;;;;6-/m0.............0/s1
InChIKeyVMMCZUFMLIFFGL-CMXFXHAFSA-N
MW2854.90 g/mol
LogP36.81
Rot. Bonds22

About 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol

2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol (PubChem CID 161339512) has the molecular formula C170H158ClN19O16S3 and a molecular weight of 2854.90 g/mol. Its IUPAC name is 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol.

Molecular Properties

Compound Name2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol
PubChem CID161339512
Molecular FormulaC170H158ClN19O16S3
Molecular Weight2854.90 g/mol
Exact Mass2852.10
IUPAC Name2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol
SMILESC=C(O)[C@@H]1CCCN1.C=C(O)c1ccccn1.CC(C)(O)c1ccccn1.CN(C)c1ccccc1O.Cc1cc(-c2ccccc2)nn1-c1ccccn1.OC(c1ccc(Cl)cc1)c1ccccn1.OC(c1ccccc1)(c1ccccc1)[C@@H]1CCCN1.OCCc1ccccn1.Oc1cccc2cccnc12.Oc1ccccc1-c1ccccn1.Oc1ccccc1-c1cn2ccccc2n1.Oc1ccccc1-c1nc2ccccc2o1.Oc1ccccc1-c1nc2ccccc2s1.Oc1ccccc1-c1nc2sc(-c3ccccc3O)nc2s1.Oc1ccccc1/N=C/C=C/c1ccccc1
InChIInChI=1S/C17H19NO.C16H10N2O2S2.C15H13N3.C15H13NO.C13H10N2O.C13H9NO2.C13H9NOS.C12H10ClNO.C11H9NO.C9H7NO.2C8H11NO.C7H7NO.C7H9NO.C6H11NO/c19-17(16-12-7-13-18-16,14-8-3-1-4-9-14)15-10-5-2-6-11-15;19-11-7-3-1-5-9(11)13-17-15-16(21-13)18-14(22-15)10-6-2-4-8-12(10)20;1-12-11-14(13-7-3-2-4-8-13)17-18(12)15-9-5-6-10-16-15;17-15-11-5-4-10-14(15)16-12-6-9-13-7-2-1-3-8-13;16-12-6-2-1-5-10(12)11-9-15-8-4-3-7-13(15)14-11;2*15-11-7-3-1-5-9(11)13-14-10-6-2-4-8-12(10)16-13;13-10-6-4-9(5-7-10)12(15)11-3-1-2-8-14-11;13-11-7-2-1-5-9(11)10-6-3-4-8-12-10;11-8-5-1-3-7-4-2-6-10-9(7)8;1-9(2)7-5-3-4-6-8(7)10;1-8(2,10)7-5-3-4-6-9-7;1-6(9)7-4-2-3-5-8-7;9-6-4-7-3-1-2-5-8-7;1-5(8)6-3-2-4-7-6/h1-6,8-11,16,18-19H,7,12-13H2;1-8,19-20H;2-11H,1H3;1-12,17H;1-9,16H;2*1-8,15H;1-8,12,15H;1-8,13H;1-6,11H;2*3-6,10H,1-2H3;2-5,9H,1H2;1-3,5,9H,4,6H2;6-8H,1-4H2/b;;;9-6+,16-12+;;;;;;;;;;;/t16-;;;;;;;;;;;;;;6-/m0.............0/s1
InChIKeyVMMCZUFMLIFFGL-CMXFXHAFSA-N
XLogP36.81
TPSA533.16 Ų
H-Bond Donors17
H-Bond Acceptors38
Rotatable Bonds22
Heavy Atoms209
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002854.90
LogP ≤ 536.81
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_phenol_A(3)', 'substructure': 'N/A'}, {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol with MolForge

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Related Compounds

4-(1-benzofuran-2-yl)-2-chloro-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1-benzofuran-2-yl)-2-methoxy-5-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1-benzofuran-2-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;4-(1-benzothiophen-2-yl)-3-[(2S)-1-methylpyrrolidin-2-yl]pyridine;N,N-dimethyl-2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]indol-1-amine;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1H-benzimidazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-benzothiazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1,3-benzoxazole;2-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]-1H-indole;3-[3-[(2S)-1-methylpyrrolidin-2-yl]-4-pyridinyl]isoquinoline
CID 158684215
1-benzofuran;bis(1,3-benzothiazole);1-benzothiophene;bis(1,3-benzoxazole);4-chloro-2-methyl-1H-indene;5H-cyclopenta[b]pyridine;7H-cyclopenta[c]pyridine;5H-cyclopenta[d]pyrimidine;2,4-dimethyl-1H-indene;2,7-dimethyl-3H-inden-5-ol;(2,7-dimethyl-3H-inden-5-yl)methanol;6-ethoxy-2-methyl-1H-indene;imidazo[1,2-a]pyridine;1H-indene;tris(2H-indene);3H-indole;indolizine;2-methyl-1H-indene;4-methyl-1H-indene;2-methyl-3H-inden-5-ol;(2-methyl-3H-inden-5-yl)methanol;7H-purine;1H-pyrrolo[2,3-b]pyridine
CID 160354373
N-[2-chloro-3-[3-[8-cyano-6-(propylaminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-2-methylphenyl]phenyl]-5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide;N-[3-[2-chloro-3-[2-[1-methyl-5-(2-methylpropyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridin-2-yl]-2-oxoethyl]phenyl]-2-methylphenyl]-5-[(2S)-2-hydroxypropyl]-1-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-2-carboxamide;N-[[8-chloro-2-[2-methyl-3-[2-methyl-3-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)phenyl]phenyl]-[1,2,4]triazolo[1,5-a]pyridin-6-yl]methyl]propan-1-amine;N-[3-[3-[8-chloro-6-(propylaminomethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-2-methylphenyl]-2-methylphenyl]-5-[(2-hydroxyethylamino)methyl]pyridine-2-carboxamide;2-[3-[3-[[7-[[(3R)-3-hydroxypyrrolidin-1-yl]methyl]pyrido[3,2-d]pyrimidin-4-yl]amino]-2-methylphenyl]-2-methylphenyl]-5-[[(3S)-3-methylpiperidin-1-yl]methyl]-1,3-benzoxazole-7-carbonitrile
CID 167556863
CID 167564334
CID 167564334
Ethane;3-methoxy-5-propan-2-ylquinoline;2-methyl-7-propan-2-yl-1,3-benzoxazole;7-propan-2-yl-1,3-benzothiazol-2-amine;7-propan-2-yl-1,3-benzothiazole;7-propan-2-yl-1,3-benzoxazole;5-propan-2-ylimidazo[1,2-a]pyridine;5-propan-2-ylisoquinoline;5-propan-2-ylquinazoline;5-propan-2-ylquinoline;(5-propan-2-ylquinolin-3-yl)methanol;5-propan-2-ylquinoxaline;5-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine;8-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 167625045
2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)methyl]-5-(4-fluorophenyl)-1,3,4-oxadiazole;2-(4-fluorophenyl)-5-[(4-methoxy-1,3-benzothiazol-2-yl)methyl]-1,3,4-oxadiazole;2-(4-fluorophenyl)-5-[(7-methoxy-3H-pyrrolo[2,3-c]pyridin-2-yl)methyl]-1,3,4-oxadiazole;2-(4-fluorophenyl)-5-[(4-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)methyl]-1,3,4-oxadiazole;2-(4-fluorophenyl)-5-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)methyl]-1,3,4-oxadiazole;5-(4-fluorophenyl)-N-(6-morpholin-4-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1,3,4-oxadiazol-2-amine;2-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-[1,3]oxazolo[4,5-b]pyridine;[2-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-3H-pyrrolo[2,3-b]pyridin-6-yl]methanol;[2-[[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methyl]-[1,3]thiazolo[5,4-b]pyridin-5-yl]methanol;hydrochloride
CID 167681319

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol?
The IUPAC name of 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol (CID 161339512) is 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol.
What is the SMILES notation for 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol?
The canonical SMILES for 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol is C=C(O)[C@@H]1CCCN1.C=C(O)c1ccccn1.CC(C)(O)c1ccccn1.CN(C)c1ccccc1O.Cc1cc(-c2ccccc2)nn1-c1ccccn1.OC(c1ccc(Cl)cc1)c1ccccn1.OC(c1ccccc1)(c1ccccc1)[C@@H]1CCCN1.OCCc1ccccn1.Oc1cccc2cccnc12.Oc1ccccc1-c1ccccn1.Oc1ccccc1-c1cn2ccccc2n1.Oc1ccccc1-c1nc2ccccc2o1.Oc1ccccc1-c1nc2ccccc2s1.Oc1ccccc1-c1nc2sc(-c3ccccc3O)nc2s1.Oc1ccccc1/N=C/C=C/c1ccccc1.
What is the InChIKey of 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol?
The InChIKey is VMMCZUFMLIFFGL-CMXFXHAFSA-N. The full InChI is InChI=1S/C17H19NO.C16H10N2O2S2.C15H13N3.C15H13NO.C13H10N2O.C13H9NO2.C13H9NOS.C12H10ClNO.C11H9NO.C9H7NO.2C8H11NO.C7H7NO.C7H9NO.C6H11NO/c19-17(16-12-7-13-18-16,14-8-3-1-4-9-14)15-10-5-2-6-11-15;19-11-7-3-1-5-9(11)13-17-15-16(21-13)18-14(22-15)10-6-2-4-8-12(10)20;1-12-11-14(13-7-3-2-4-8-13)17-18(12)15-9-5-6-10-16-15;17-15-11-5-4-10-14(15)16-12-6-9-13-7-2-1-3-8-13;16-12-6-2-1-5-10(12)11-9-15-8-4-3-7-13(15)14-11;2*15-11-7-3-1-5-9(11)13-14-10-6-2-4-8-12(10)16-13;13-10-6-4-9(5-7-10)12(15)11-3-1-2-8-14-11;13-11-7-2-1-5-9(11)10-6-3-4-8-12-10;11-8-5-1-3-7-4-2-6-10-9(7)8;1-9(2)7-5-3-4-6-8(7)10;1-8(2,10)7-5-3-4-6-9-7;1-6(9)7-4-2-3-5-8-7;9-6-4-7-3-1-2-5-8-7;1-5(8)6-3-2-4-7-6/h1-6,8-11,16,18-19H,7,12-13H2;1-8,19-20H;2-11H,1H3;1-12,17H;1-9,16H;2*1-8,15H;1-8,12,15H;1-8,13H;1-6,11H;2*3-6,10H,1-2H3;2-5,9H,1H2;1-3,5,9H,4,6H2;6-8H,1-4H2/b;;;9-6+,16-12+;;;;;;;;;;;/t16-;;;;;;;;;;;;;;6-/m0.............0/s1.
What are the key properties of 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol?
2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol has a molecular weight of 2854.90 g/mol, XLogP of 36.81, 22 rotatable bonds, 17 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-benzothiazol-2-yl)phenol;2-(1,3-benzoxazol-2-yl)phenol;(4-chlorophenyl)-pyridin-2-ylmethanol;2-(dimethylamino)phenol;diphenyl-[(2S)-pyrrolidin-2-yl]methanol;2-[5-(2-hydroxyphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]phenol;2-imidazo[1,2-a]pyridin-2-ylphenol;2-(5-methyl-3-phenylpyrazol-1-yl)pyridine;2-[[(E)-3-phenylprop-2-enylidene]amino]phenol;2-pyridin-2-ylethanol;1-pyridin-2-ylethenol;2-pyridin-2-ylphenol;2-pyridin-2-ylpropan-2-ol;1-[(2S)-pyrrolidin-2-yl]ethenol;quinolin-8-ol is sourced from PubChem (CID 161339512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).