1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide

C165H170F6N26O7S6 — CID 157294676

IUPAC1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide
SMILESCCN1CCN(Cc2ccc(CC(=O)c3ccc(C)c(-c4cnc5sc(N)nc5c4)c3)cc2)CC1.CCN1CCN(Cc2ccc(CC(=O)c3ccc(C)c(-c4cnc5sc(N)nc5c4)c3)cc2C(F)(F)F)CC1.CCN1CCN(Cc2ccc(CC(=O)c3ccc(C)c(-c4cnc5sc(NC(C)=O)nc5c4)c3)cc2C(F)(F)F)CC1.Cc1ccc(C(=O)Cc2ccc(C(C)(C)C)cc2)cc1-c1cnc2sc(N)nc2c1.Cc1ccc(C(=O)Cc2ccc(N3CCCCC3)cc2)cc1-c1cnc2sc(N)nc2c1.Cc1ccc(C(=O)Cc2cccc(N3CCCCC3)c2)cc1-c1cnc2sc(N)nc2c1
InChIInChI=1S/C31H32F3N5O2S.C29H30F3N5OS.C28H31N5OS.2C26H26N4OS.C25H25N3OS/c1-4-38-9-11-39(12-10-38)18-23-8-6-21(13-26(23)31(32,33)34)14-28(41)22-7-5-19(2)25(15-22)24-16-27-29(35-17-24)42-30(37-27)36-20(3)40;1-3-36-8-10-37(11-9-36)17-21-7-5-19(12-24(21)29(30,31)32)13-26(38)20-6-4-18(2)23(14-20)22-15-25-27(34-16-22)39-28(33)35-25;1-3-32-10-12-33(13-11-32)18-21-7-5-20(6-8-21)14-26(34)22-9-4-19(2)24(15-22)23-16-25-27(30-17-23)35-28(29)31-25;1-17-5-8-19(14-22(17)20-15-23-25(28-16-20)32-26(27)29-23)24(31)13-18-6-9-21(10-7-18)30-11-3-2-4-12-30;1-17-8-9-19(14-22(17)20-15-23-25(28-16-20)32-26(27)29-23)24(31)13-18-6-5-7-21(12-18)30-10-3-2-4-11-30;1-15-5-8-17(22(29)11-16-6-9-19(10-7-16)25(2,3)4)12-20(15)18-13-21-23(27-14-18)30-24(26)28-21/h5-8,13,15-17H,4,9-12,14,18H2,1-3H3,(H,36,37,40);4-7,12,14-16H,3,8-11,13,17H2,1-2H3,(H2,33,35);4-9,15-17H,3,10-14,18H2,1-2H3,(H2,29,31);5-10,14-16H,2-4,11-13H2,1H3,(H2,27,29);5-9,12,14-16H,2-4,10-11,13H2,1H3,(H2,27,29);5-10,12-14H,11H2,1-4H3,(H2,26,28)
InChIKeyBBFCNKZNFHZSGQ-UHFFFAOYSA-N
MW2935.74 g/mol
LogP34.15
Rot. Bonds36

About 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide

1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide (PubChem CID 157294676) has the molecular formula C165H170F6N26O7S6 and a molecular weight of 2935.74 g/mol. Its IUPAC name is 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide.

Molecular Properties

Compound Name1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide
PubChem CID157294676
Molecular FormulaC165H170F6N26O7S6
Molecular Weight2935.74 g/mol
Exact Mass2933.20
IUPAC Name1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide
SMILESCCN1CCN(Cc2ccc(CC(=O)c3ccc(C)c(-c4cnc5sc(N)nc5c4)c3)cc2)CC1.CCN1CCN(Cc2ccc(CC(=O)c3ccc(C)c(-c4cnc5sc(N)nc5c4)c3)cc2C(F)(F)F)CC1.CCN1CCN(Cc2ccc(CC(=O)c3ccc(C)c(-c4cnc5sc(NC(C)=O)nc5c4)c3)cc2C(F)(F)F)CC1.Cc1ccc(C(=O)Cc2ccc(C(C)(C)C)cc2)cc1-c1cnc2sc(N)nc2c1.Cc1ccc(C(=O)Cc2ccc(N3CCCCC3)cc2)cc1-c1cnc2sc(N)nc2c1.Cc1ccc(C(=O)Cc2cccc(N3CCCCC3)c2)cc1-c1cnc2sc(N)nc2c1
InChIInChI=1S/C31H32F3N5O2S.C29H30F3N5OS.C28H31N5OS.2C26H26N4OS.C25H25N3OS/c1-4-38-9-11-39(12-10-38)18-23-8-6-21(13-26(23)31(32,33)34)14-28(41)22-7-5-19(2)25(15-22)24-16-27-29(35-17-24)42-30(37-27)36-20(3)40;1-3-36-8-10-37(11-9-36)17-21-7-5-19(12-24(21)29(30,31)32)13-26(38)20-6-4-18(2)23(14-20)22-15-25-27(34-16-22)39-28(33)35-25;1-3-32-10-12-33(13-11-32)18-21-7-5-20(6-8-21)14-26(34)22-9-4-19(2)24(15-22)23-16-25-27(30-17-23)35-28(29)31-25;1-17-5-8-19(14-22(17)20-15-23-25(28-16-20)32-26(27)29-23)24(31)13-18-6-9-21(10-7-18)30-11-3-2-4-12-30;1-17-8-9-19(14-22(17)20-15-23-25(28-16-20)32-26(27)29-23)24(31)13-18-6-5-7-21(12-18)30-10-3-2-4-11-30;1-15-5-8-17(22(29)11-16-6-9-19(10-7-16)25(2,3)4)12-20(15)18-13-21-23(27-14-18)30-24(26)28-21/h5-8,13,15-17H,4,9-12,14,18H2,1-3H3,(H,36,37,40);4-7,12,14-16H,3,8-11,13,17H2,1-2H3,(H2,33,35);4-9,15-17H,3,10-14,18H2,1-2H3,(H2,29,31);5-10,14-16H,2-4,11-13H2,1H3,(H2,27,29);5-9,12,14-16H,2-4,10-11,13H2,1H3,(H2,27,29);5-10,12-14H,11H2,1-4H3,(H2,26,28)
InChIKeyBBFCNKZNFHZSGQ-UHFFFAOYSA-N
XLogP34.15
TPSA442.22 Ų
H-Bond Donors6
H-Bond Acceptors38
Rotatable Bonds36
Heavy Atoms210
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002935.74
LogP ≤ 534.15
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide?
The IUPAC name of 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide (CID 157294676) is 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide.
What is the SMILES notation for 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide?
The canonical SMILES for 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide is CCN1CCN(Cc2ccc(CC(=O)c3ccc(C)c(-c4cnc5sc(N)nc5c4)c3)cc2)CC1.CCN1CCN(Cc2ccc(CC(=O)c3ccc(C)c(-c4cnc5sc(N)nc5c4)c3)cc2C(F)(F)F)CC1.CCN1CCN(Cc2ccc(CC(=O)c3ccc(C)c(-c4cnc5sc(NC(C)=O)nc5c4)c3)cc2C(F)(F)F)CC1.Cc1ccc(C(=O)Cc2ccc(C(C)(C)C)cc2)cc1-c1cnc2sc(N)nc2c1.Cc1ccc(C(=O)Cc2ccc(N3CCCCC3)cc2)cc1-c1cnc2sc(N)nc2c1.Cc1ccc(C(=O)Cc2cccc(N3CCCCC3)c2)cc1-c1cnc2sc(N)nc2c1.
What is the InChIKey of 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide?
The InChIKey is BBFCNKZNFHZSGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H32F3N5O2S.C29H30F3N5OS.C28H31N5OS.2C26H26N4OS.C25H25N3OS/c1-4-38-9-11-39(12-10-38)18-23-8-6-21(13-26(23)31(32,33)34)14-28(41)22-7-5-19(2)25(15-22)24-16-27-29(35-17-24)42-30(37-27)36-20(3)40;1-3-36-8-10-37(11-9-36)17-21-7-5-19(12-24(21)29(30,31)32)13-26(38)20-6-4-18(2)23(14-20)22-15-25-27(34-16-22)39-28(33)35-25;1-3-32-10-12-33(13-11-32)18-21-7-5-20(6-8-21)14-26(34)22-9-4-19(2)24(15-22)23-16-25-27(30-17-23)35-28(29)31-25;1-17-5-8-19(14-22(17)20-15-23-25(28-16-20)32-26(27)29-23)24(31)13-18-6-9-21(10-7-18)30-11-3-2-4-12-30;1-17-8-9-19(14-22(17)20-15-23-25(28-16-20)32-26(27)29-23)24(31)13-18-6-5-7-21(12-18)30-10-3-2-4-11-30;1-15-5-8-17(22(29)11-16-6-9-19(10-7-16)25(2,3)4)12-20(15)18-13-21-23(27-14-18)30-24(26)28-21/h5-8,13,15-17H,4,9-12,14,18H2,1-3H3,(H,36,37,40);4-7,12,14-16H,3,8-11,13,17H2,1-2H3,(H2,33,35);4-9,15-17H,3,10-14,18H2,1-2H3,(H2,29,31);5-10,14-16H,2-4,11-13H2,1H3,(H2,27,29);5-9,12,14-16H,2-4,10-11,13H2,1H3,(H2,27,29);5-10,12-14H,11H2,1-4H3,(H2,26,28).
What are the key properties of 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide?
1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide has a molecular weight of 2935.74 g/mol, XLogP of 34.15, 36 rotatable bonds, 6 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-tert-butylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(3-piperidin-1-ylphenyl)ethanone;1-[3-(2-amino-[1,3]thiazolo[5,4-b]pyridin-6-yl)-4-methylphenyl]-2-(4-piperidin-1-ylphenyl)ethanone;N-[6-[5-[2-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]acetyl]-2-methylphenyl]-[1,3]thiazolo[5,4-b]pyridin-2-yl]acetamide is sourced from PubChem (CID 157294676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).