2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide

C94H56F14N22O21S3 — CID 160558849

IUPAC2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1coc(-c2ccc3c(c2)CCO3)n1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1csc(-c2ccc3c(c2)CCO3)c1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1csc(-c2ccc3c(c2)OCO3)n1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1csc(N2CCOCC2)n1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1nnn(-c2cccc(F)c2)c1C(F)(F)F
InChIInChI=1S/C21H13F2N3O4S.C20H12F2N4O5.C19H10F2N4O5S.C18H8F6N6O3.C16H13F2N5O4S/c22-21(23)29-16-7-13-14(8-17(16)30-21)25-20(24-13)26-19(27)12-6-18(31-9-12)11-1-2-15-10(5-11)3-4-28-15;21-20(22)30-15-6-11-12(7-16(15)31-20)25-19(24-11)26-17(27)13-8-29-18(23-13)10-1-2-14-9(5-10)3-4-28-14;20-19(21)29-14-4-9-10(5-15(14)30-19)24-18(23-9)25-16(26)11-6-31-17(22-11)8-1-2-12-13(3-8)28-7-27-12;19-7-2-1-3-8(4-7)30-14(17(20,21)22)13(28-29-30)15(31)27-16-25-9-5-11-12(6-10(9)26-16)33-18(23,24)32-11;17-16(18)26-11-5-8-9(6-12(11)27-16)20-14(19-8)22-13(24)10-7-28-15(21-10)23-1-3-25-4-2-23/h1-2,5-9H,3-4H2,(H2,24,25,26,27);1-2,5-8H,3-4H2,(H2,24,25,26,27);1-6H,7H2,(H2,23,24,25,26);1-6H,(H2,25,26,27,31);5-7H,1-4H2,(H2,19,20,22,24)
InChIKeyQZAUREFFCGKXCJ-UHFFFAOYSA-N
MW2191.79 g/mol
LogP18.82
Rot. Bonds15

About 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide

2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide (PubChem CID 160558849) has the molecular formula C94H56F14N22O21S3 and a molecular weight of 2191.79 g/mol. Its IUPAC name is 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide
PubChem CID160558849
Molecular FormulaC94H56F14N22O21S3
Molecular Weight2191.79 g/mol
Exact Mass2190.29
IUPAC Name2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1coc(-c2ccc3c(c2)CCO3)n1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1csc(-c2ccc3c(c2)CCO3)c1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1csc(-c2ccc3c(c2)OCO3)n1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1csc(N2CCOCC2)n1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1nnn(-c2cccc(F)c2)c1C(F)(F)F
InChIInChI=1S/C21H13F2N3O4S.C20H12F2N4O5.C19H10F2N4O5S.C18H8F6N6O3.C16H13F2N5O4S/c22-21(23)29-16-7-13-14(8-17(16)30-21)25-20(24-13)26-19(27)12-6-18(31-9-12)11-1-2-15-10(5-11)3-4-28-15;21-20(22)30-15-6-11-12(7-16(15)31-20)25-19(24-11)26-17(27)13-8-29-18(23-13)10-1-2-14-9(5-10)3-4-28-14;20-19(21)29-14-4-9-10(5-15(14)30-19)24-18(23-9)25-16(26)11-6-31-17(22-11)8-1-2-12-13(3-8)28-7-27-12;19-7-2-1-3-8(4-7)30-14(17(20,21)22)13(28-29-30)15(31)27-16-25-9-5-11-12(6-10(9)26-16)33-18(23,24)32-11;17-16(18)26-11-5-8-9(6-12(11)27-16)20-14(19-8)22-13(24)10-7-28-15(21-10)23-1-3-25-4-2-23/h1-2,5-9H,3-4H2,(H2,24,25,26,27);1-2,5-8H,3-4H2,(H2,24,25,26,27);1-6H,7H2,(H2,23,24,25,26);1-6H,(H2,25,26,27,31);5-7H,1-4H2,(H2,19,20,22,24)
InChIKeyQZAUREFFCGKXCJ-UHFFFAOYSA-N
XLogP18.82
TPSA513.11 Ų
H-Bond Donors10
H-Bond Acceptors36
Rotatable Bonds15
Heavy Atoms154
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002191.79
LogP ≤ 518.82
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1036

Analyze 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide with MolForge

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Related Compounds

N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2,5-dimethylthiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-[[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]amino]-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)pyrazine-2-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-[4-(trifluoromethoxy)anilino]-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-[[2-(trifluoromethoxy)phenyl]carbamoylamino]-1,3-thiazole-4-carboxamide
CID 159053222
N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(4-methylthiadiazol-5-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(1,3-thiazol-4-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-thiophen-2-yl-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 160138033
N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-3,5-dimethoxybenzamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-3-(1,3-thiazol-2-yl)benzamide;N-(2,2-difluoro-7H-[1,3]dioxolo[4,5-f]indol-6-yl)-5-(furan-2-yl)pyridine-3-carboxamide;N-(2,2-difluoro-7H-[1,3]dioxolo[4,5-f]indol-6-yl)-2-(3-methoxyphenyl)acetamide;N-(2,2-difluoro-7H-[1,3]dioxolo[4,5-f]indol-6-yl)-3-(2H-pyrrol-5-yl)benzamide
CID 160978456
(2S)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(6-methoxynaphthalen-2-yl)propanamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)benzamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(4-methylthiadiazol-5-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(1,3-thiazol-4-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-thiophen-2-yl-1,3-oxazole-4-carboxamide
CID 161076275
N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(4-fluorophenyl)-5-methylpyrazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-phenyl-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-[[2-(trifluoromethoxy)benzoyl]amino]-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxamide
CID 161683960

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide (CID 160558849) is 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide is O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1coc(-c2ccc3c(c2)CCO3)n1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1csc(-c2ccc3c(c2)CCO3)c1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1csc(-c2ccc3c(c2)OCO3)n1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1csc(N2CCOCC2)n1.O=C(Nc1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1nnn(-c2cccc(F)c2)c1C(F)(F)F.
What is the InChIKey of 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide?
The InChIKey is QZAUREFFCGKXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13F2N3O4S.C20H12F2N4O5.C19H10F2N4O5S.C18H8F6N6O3.C16H13F2N5O4S/c22-21(23)29-16-7-13-14(8-17(16)30-21)25-20(24-13)26-19(27)12-6-18(31-9-12)11-1-2-15-10(5-11)3-4-28-15;21-20(22)30-15-6-11-12(7-16(15)31-20)25-19(24-11)26-17(27)13-8-29-18(23-13)10-1-2-14-9(5-10)3-4-28-14;20-19(21)29-14-4-9-10(5-15(14)30-19)24-18(23-9)25-16(26)11-6-31-17(22-11)8-1-2-12-13(3-8)28-7-27-12;19-7-2-1-3-8(4-7)30-14(17(20,21)22)13(28-29-30)15(31)27-16-25-9-5-11-12(6-10(9)26-16)33-18(23,24)32-11;17-16(18)26-11-5-8-9(6-12(11)27-16)20-14(19-8)22-13(24)10-7-28-15(21-10)23-1-3-25-4-2-23/h1-2,5-9H,3-4H2,(H2,24,25,26,27);1-2,5-8H,3-4H2,(H2,24,25,26,27);1-6H,7H2,(H2,23,24,25,26);1-6H,(H2,25,26,27,31);5-7H,1-4H2,(H2,19,20,22,24).
What are the key properties of 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide?
2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide has a molecular weight of 2191.79 g/mol, XLogP of 18.82, 15 rotatable bonds, 10 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-benzodioxol-5-yl)-N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1,3-thiazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-oxazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-5-(2,3-dihydro-1-benzofuran-5-yl)thiophene-3-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-1-(3-fluorophenyl)-5-(trifluoromethyl)triazole-4-carboxamide;N-(2,2-difluoro-5H-[1,3]dioxolo[4,5-f]benzimidazol-6-yl)-2-morpholin-4-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 160558849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).