N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide

C111H103FN40O9S — CID 159716750

IUPACN-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide
SMILESCN1CCC(C(=O)Nc2n[nH]c(-c3ccccn3)n2)CC1=O.O=C(CC1=NN=C(c2ccccn2)C1)NCc1nc2ccccc2s1.O=C(CCNc1ncccn1)Nc1n[nH]c(-c2ccccn2)n1.O=C(CCc1ccc(F)cc1)Nc1n[nH]c(-c2ccccn2)n1.O=C(CCc1ccccn1)Nc1n[nH]c(-c2ccccn2)n1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C1CC=CCC1.O=C(Nc1n[nH]c(-c2ccccn2)n1)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C20H15N5O2.C18H15N5OS.C16H14FN5O.C15H14N6O.C14H14N8O.C14H16N6O2.C14H15N5O/c26-19(23-20-22-18(24-25-20)17-8-4-5-13-21-17)14-9-11-16(12-10-14)27-15-6-2-1-3-7-15;24-17(20-11-18-21-14-6-1-2-7-16(14)25-18)10-12-9-15(23-22-12)13-5-3-4-8-19-13;17-12-7-4-11(5-8-12)6-9-14(23)19-16-20-15(21-22-16)13-3-1-2-10-18-13;22-13(8-7-11-5-1-3-9-16-11)18-15-19-14(20-21-15)12-6-2-4-10-17-12;23-11(5-9-18-13-16-7-3-8-17-13)19-14-20-12(21-22-14)10-4-1-2-6-15-10;1-20-7-5-9(8-11(20)21)13(22)17-14-16-12(18-19-14)10-4-2-3-6-15-10;20-13(10-6-2-1-3-7-10)17-14-16-12(18-19-14)11-8-4-5-9-15-11/h1-13H,(H2,22,23,24,25,26);1-8H,9-11H2,(H,20,24);1-5,7-8,10H,6,9H2,(H2,19,20,21,22,23);1-6,9-10H,7-8H2,(H2,18,19,20,21,22);1-4,6-8H,5,9H2,(H,16,17,18)(H2,19,20,21,22,23);2-4,6,9H,5,7-8H2,1H3,(H2,16,17,18,19,22);1-2,4-5,8-10H,3,6-7H2,(H2,16,17,18,19,20)
InChIKeyMZNLISRUGJSUGG-UHFFFAOYSA-N
MW2192.38 g/mol
LogP15.20
Rot. Bonds32

About N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide

N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide (PubChem CID 159716750) has the molecular formula C111H103FN40O9S and a molecular weight of 2192.38 g/mol. Its IUPAC name is N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide.

Molecular Properties

Compound NameN-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide
PubChem CID159716750
Molecular FormulaC111H103FN40O9S
Molecular Weight2192.38 g/mol
Exact Mass2190.85
IUPAC NameN-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide
SMILESCN1CCC(C(=O)Nc2n[nH]c(-c3ccccn3)n2)CC1=O.O=C(CC1=NN=C(c2ccccn2)C1)NCc1nc2ccccc2s1.O=C(CCNc1ncccn1)Nc1n[nH]c(-c2ccccn2)n1.O=C(CCc1ccc(F)cc1)Nc1n[nH]c(-c2ccccn2)n1.O=C(CCc1ccccn1)Nc1n[nH]c(-c2ccccn2)n1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C1CC=CCC1.O=C(Nc1n[nH]c(-c2ccccn2)n1)c1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C20H15N5O2.C18H15N5OS.C16H14FN5O.C15H14N6O.C14H14N8O.C14H16N6O2.C14H15N5O/c26-19(23-20-22-18(24-25-20)17-8-4-5-13-21-17)14-9-11-16(12-10-14)27-15-6-2-1-3-7-15;24-17(20-11-18-21-14-6-1-2-7-16(14)25-18)10-12-9-15(23-22-12)13-5-3-4-8-19-13;17-12-7-4-11(5-8-12)6-9-14(23)19-16-20-15(21-22-16)13-3-1-2-10-18-13;22-13(8-7-11-5-1-3-9-16-11)18-15-19-14(20-21-15)12-6-2-4-10-17-12;23-11(5-9-18-13-16-7-3-8-17-13)19-14-20-12(21-22-14)10-4-1-2-6-15-10;1-20-7-5-9(8-11(20)21)13(22)17-14-16-12(18-19-14)10-4-2-3-6-15-10;20-13(10-6-2-1-3-7-10)17-14-16-12(18-19-14)11-8-4-5-9-15-11/h1-13H,(H2,22,23,24,25,26);1-8H,9-11H2,(H,20,24);1-5,7-8,10H,6,9H2,(H2,19,20,21,22,23);1-6,9-10H,7-8H2,(H2,18,19,20,21,22);1-4,6-8H,5,9H2,(H,16,17,18)(H2,19,20,21,22,23);2-4,6,9H,5,7-8H2,1H3,(H2,16,17,18,19,22);1-2,4-5,8-10H,3,6-7H2,(H2,16,17,18,19,20)
InChIKeyMZNLISRUGJSUGG-UHFFFAOYSA-N
XLogP15.20
TPSA661.20 Ų
H-Bond Donors14
H-Bond Acceptors36
Rotatable Bonds32
Heavy Atoms162
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002192.38
LogP ≤ 515.20
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide with MolForge

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Related Compounds

4-[3-(cyclohexylamino)-1-[(4-methoxyphenyl)methyl]pyrazolo[3,4-b]pyridin-4-yl]oxy-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;4-[[3-(cyclohexylamino)-1H-pyrazolo[3,4-b]pyridin-4-yl]oxy]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-2-yl)benzamide;2,2,2-trifluoroacetic acid
CID 158776034
4-(1,3-benzothiazol-2-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)butanamide;2-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;1-(3-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)pyrazole-3-carboxamide;3-(3H-inden-1-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-[(3-methoxyphenyl)methoxy]-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-methyl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1-benzofuran-2-carboxamide;4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide;1-propan-2-yl-3-[3-[2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetyl]phenyl]urea
CID 158964444
4-(1,3-benzothiazol-2-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)butanamide;2-[5,7-dimethyl-2-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;1-[1-(3-fluorophenyl)pyrazol-3-yl]-2-(3-pyridin-2-yl-1H-1,2,4-triazol-5-yl)ethanone;3-(3H-inden-1-yl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;2-[(3-methoxyphenyl)methoxy]-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)acetamide;3-methyl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1-benzofuran-2-carboxamide;4-methyl-2-pyridin-2-yl-N-(5-pyridin-2-yl-4H-pyrazol-3-yl)-1,3-thiazole-5-carboxamide;1-propan-2-yl-3-[3-[2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetyl]phenyl]urea
CID 159390868
N-(1,3-benzothiazol-2-yl)-4-[[3-[[(3R)-1-(1-methylpiperidine-4-carbonyl)piperidin-3-yl]amino]-1H-pyrazolo[3,4-b]pyridin-4-yl]oxy]benzamide
CID 118623186
N-(1,3-benzothiazol-2-yl)-4-[[3-[[(3R)-1-[(E)-4-[cyclopropyl(methyl)amino]but-2-enoyl]piperidin-3-yl]amino]-1H-pyrazolo[3,4-b]pyridin-4-yl]oxy]benzamide
CID 118623341
(3R)-3-[(4-{4-[(1,3-benzothiazol-2-yl)carbamoyl]phenoxy}-1H-pyrazolo[3,4-b]pyridin-3-yl)amino]-N-ethylpiperidine-1-carboxamide hydrochloride
CID 118623515
(3R)-3-[(4-{4-[(1,3-benzothiazol-2-yl)carbamoyl]phenoxy}-1H-pyrazolo[3,4-b]pyridin-3-yl)amino]-N-ethylpiperidine-1-carboxamide
CID 118623516
N-(1,3-benzothiazol-2-yl)-4-[[3-[[(3R)-1-but-2-ynoylpiperidin-3-yl]amino]-1H-pyrazolo[3,4-b]pyridin-4-yl]oxy]benzamide
CID 118623790
N-(1,3-Benzothiazol-2-yl)-4-[(3-{[(3R)-1-[4-(dimethylamino)butanoyl]piperidin-3-yl]amino}-1H-pyrazolo[3,4-b]pyridin-4-yl)oxy]benzamide
CID 118623813
N-(1,3-benzothiazol-2-yl)-4-[[3-[[(3S)-1-prop-2-enoylpiperidin-3-yl]amino]-1H-pyrazolo[3,4-b]pyridin-4-yl]oxy]benzamide
CID 118624293
N-(1,3-benzothiazol-2-yl)-4-[[3-[[(3R)-1-prop-2-enoylpiperidin-3-yl]amino]-1H-pyrazolo[3,4-b]pyridin-4-yl]oxy]benzamide
CID 118636015
N-(1,3-benzothiazol-2-yl)-4-[[3-[[1-(1-methylpiperidine-4-carbonyl)piperidin-3-yl]amino]-1H-pyrazolo[3,4-b]pyridin-4-yl]oxy]benzamide
CID 118636042

Frequently Asked Questions

What is the IUPAC name of N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide?
The IUPAC name of N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide (CID 159716750) is N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide.
What is the SMILES notation for N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide?
The canonical SMILES for N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide is CN1CCC(C(=O)Nc2n[nH]c(-c3ccccn3)n2)CC1=O.O=C(CC1=NN=C(c2ccccn2)C1)NCc1nc2ccccc2s1.O=C(CCNc1ncccn1)Nc1n[nH]c(-c2ccccn2)n1.O=C(CCc1ccc(F)cc1)Nc1n[nH]c(-c2ccccn2)n1.O=C(CCc1ccccn1)Nc1n[nH]c(-c2ccccn2)n1.O=C(Nc1n[nH]c(-c2ccccn2)n1)C1CC=CCC1.O=C(Nc1n[nH]c(-c2ccccn2)n1)c1ccc(Oc2ccccc2)cc1.
What is the InChIKey of N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide?
The InChIKey is MZNLISRUGJSUGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O2.C18H15N5OS.C16H14FN5O.C15H14N6O.C14H14N8O.C14H16N6O2.C14H15N5O/c26-19(23-20-22-18(24-25-20)17-8-4-5-13-21-17)14-9-11-16(12-10-14)27-15-6-2-1-3-7-15;24-17(20-11-18-21-14-6-1-2-7-16(14)25-18)10-12-9-15(23-22-12)13-5-3-4-8-19-13;17-12-7-4-11(5-8-12)6-9-14(23)19-16-20-15(21-22-16)13-3-1-2-10-18-13;22-13(8-7-11-5-1-3-9-16-11)18-15-19-14(20-21-15)12-6-2-4-10-17-12;23-11(5-9-18-13-16-7-3-8-17-13)19-14-20-12(21-22-14)10-4-1-2-6-15-10;1-20-7-5-9(8-11(20)21)13(22)17-14-16-12(18-19-14)10-4-2-3-6-15-10;20-13(10-6-2-1-3-7-10)17-14-16-12(18-19-14)11-8-4-5-9-15-11/h1-13H,(H2,22,23,24,25,26);1-8H,9-11H2,(H,20,24);1-5,7-8,10H,6,9H2,(H2,19,20,21,22,23);1-6,9-10H,7-8H2,(H2,18,19,20,21,22);1-4,6-8H,5,9H2,(H,16,17,18)(H2,19,20,21,22,23);2-4,6,9H,5,7-8H2,1H3,(H2,16,17,18,19,22);1-2,4-5,8-10H,3,6-7H2,(H2,16,17,18,19,20).
What are the key properties of N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide?
N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide has a molecular weight of 2192.38 g/mol, XLogP of 15.20, 32 rotatable bonds, 14 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-benzothiazol-2-ylmethyl)-2-(5-pyridin-2-yl-4H-pyrazol-3-yl)acetamide;3-(4-fluorophenyl)-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;1-methyl-2-oxo-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)piperidine-4-carboxamide;4-phenoxy-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)benzamide;3-pyridin-2-yl-N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)propanamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)cyclohex-3-ene-1-carboxamide;N-(5-pyridin-2-yl-1H-1,2,4-triazol-3-yl)-3-(pyrimidin-2-ylamino)propanamide is sourced from PubChem (CID 159716750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).