1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea

C99H135F3N26O26S6 — CID 161247437

IUPAC1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea
SMILESCC(C)(C)c1cc(C(C)(C)C)nc(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)n1.CC(C)n1ccc(S(=O)(=O)NC(=O)Nc2nc(C(C)(C)C)cc(C(C)(C)C)n2)n1.Cc1cc(C)c(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)c(C(F)(F)F)c1.Cc1cc(C)nc(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)n1.Cc1cc(C)nc(NC(=O)NS(=O)(=O)c2ccn(C(C)C)n2)n1.Cc1cc(C2CC2)nc(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)n1
InChIInChI=1S/C20H30N4O5S.C19H30N6O3S.C17H19F3N2O5S.C16H20N4O5S.C14H18N4O5S.C13H18N6O3S/c1-18(2,3)13-10-14(19(4,5)6)22-16(21-13)23-17(25)24-30(27,28)15-9-12(11-29-15)20(7,8)26;1-12(2)25-10-9-15(23-25)29(27,28)24-17(26)22-16-20-13(18(3,4)5)11-14(21-16)19(6,7)8;1-9-5-10(2)14(12(6-9)17(18,19)20)21-15(23)22-28(25,26)13-7-11(8-27-13)16(3,4)24;1-9-6-12(10-4-5-10)18-14(17-9)19-15(21)20-26(23,24)13-7-11(8-25-13)16(2,3)22;1-8-5-9(2)16-12(15-8)17-13(19)18-24(21,22)11-6-10(7-23-11)14(3,4)20;1-8(2)19-6-5-11(17-19)23(21,22)18-13(20)16-12-14-9(3)7-10(4)15-12/h9-11,26H,1-8H3,(H2,21,22,23,24,25);9-12H,1-8H3,(H2,20,21,22,24,26);5-8,24H,1-4H3,(H2,21,22,23);6-8,10,22H,4-5H2,1-3H3,(H2,17,18,19,20,21);5-7,20H,1-4H3,(H2,15,16,17,18,19);5-8H,1-4H3,(H2,14,15,16,18,20)
InChIKeyVAVAWZZITRTOHO-UHFFFAOYSA-N
MW2354.72 g/mol
LogP15.21
Rot. Bonds25

About 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea

1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea (PubChem CID 161247437) has the molecular formula C99H135F3N26O26S6 and a molecular weight of 2354.72 g/mol. Its IUPAC name is 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea.

Molecular Properties

Compound Name1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea
PubChem CID161247437
Molecular FormulaC99H135F3N26O26S6
Molecular Weight2354.72 g/mol
Exact Mass2352.83
IUPAC Name1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea
SMILESCC(C)(C)c1cc(C(C)(C)C)nc(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)n1.CC(C)n1ccc(S(=O)(=O)NC(=O)Nc2nc(C(C)(C)C)cc(C(C)(C)C)n2)n1.Cc1cc(C)c(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)c(C(F)(F)F)c1.Cc1cc(C)nc(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)n1.Cc1cc(C)nc(NC(=O)NS(=O)(=O)c2ccn(C(C)C)n2)n1.Cc1cc(C2CC2)nc(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)n1
InChIInChI=1S/C20H30N4O5S.C19H30N6O3S.C17H19F3N2O5S.C16H20N4O5S.C14H18N4O5S.C13H18N6O3S/c1-18(2,3)13-10-14(19(4,5)6)22-16(21-13)23-17(25)24-30(27,28)15-9-12(11-29-15)20(7,8)26;1-12(2)25-10-9-15(23-25)29(27,28)24-17(26)22-16-20-13(18(3,4)5)11-14(21-16)19(6,7)8;1-9-5-10(2)14(12(6-9)17(18,19)20)21-15(23)22-28(25,26)13-7-11(8-27-13)16(3,4)24;1-9-6-12(10-4-5-10)18-14(17-9)19-15(21)20-26(23,24)13-7-11(8-25-13)16(2,3)22;1-8-5-9(2)16-12(15-8)17-13(19)18-24(21,22)11-6-10(7-23-11)14(3,4)20;1-8(2)19-6-5-11(17-19)23(21,22)18-13(20)16-12-14-9(3)7-10(4)15-12/h9-11,26H,1-8H3,(H2,21,22,23,24,25);9-12H,1-8H3,(H2,20,21,22,24,26);5-8,24H,1-4H3,(H2,21,22,23);6-8,10,22H,4-5H2,1-3H3,(H2,17,18,19,20,21);5-7,20H,1-4H3,(H2,15,16,17,18,19);5-8H,1-4H3,(H2,14,15,16,18,20)
InChIKeyVAVAWZZITRTOHO-UHFFFAOYSA-N
XLogP15.21
TPSA749.64 Ų
H-Bond Donors16
H-Bond Acceptors40
Rotatable Bonds25
Heavy Atoms160
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002354.72
LogP ≤ 515.21
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1040

Analyze 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea?
The IUPAC name of 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea (CID 161247437) is 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea.
What is the SMILES notation for 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea?
The canonical SMILES for 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea is CC(C)(C)c1cc(C(C)(C)C)nc(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)n1.CC(C)n1ccc(S(=O)(=O)NC(=O)Nc2nc(C(C)(C)C)cc(C(C)(C)C)n2)n1.Cc1cc(C)c(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)c(C(F)(F)F)c1.Cc1cc(C)nc(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)n1.Cc1cc(C)nc(NC(=O)NS(=O)(=O)c2ccn(C(C)C)n2)n1.Cc1cc(C2CC2)nc(NC(=O)NS(=O)(=O)c2cc(C(C)(C)O)co2)n1.
What is the InChIKey of 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea?
The InChIKey is VAVAWZZITRTOHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O5S.C19H30N6O3S.C17H19F3N2O5S.C16H20N4O5S.C14H18N4O5S.C13H18N6O3S/c1-18(2,3)13-10-14(19(4,5)6)22-16(21-13)23-17(25)24-30(27,28)15-9-12(11-29-15)20(7,8)26;1-12(2)25-10-9-15(23-25)29(27,28)24-17(26)22-16-20-13(18(3,4)5)11-14(21-16)19(6,7)8;1-9-5-10(2)14(12(6-9)17(18,19)20)21-15(23)22-28(25,26)13-7-11(8-27-13)16(3,4)24;1-9-6-12(10-4-5-10)18-14(17-9)19-15(21)20-26(23,24)13-7-11(8-25-13)16(2,3)22;1-8-5-9(2)16-12(15-8)17-13(19)18-24(21,22)11-6-10(7-23-11)14(3,4)20;1-8(2)19-6-5-11(17-19)23(21,22)18-13(20)16-12-14-9(3)7-10(4)15-12/h9-11,26H,1-8H3,(H2,21,22,23,24,25);9-12H,1-8H3,(H2,20,21,22,24,26);5-8,24H,1-4H3,(H2,21,22,23);6-8,10,22H,4-5H2,1-3H3,(H2,17,18,19,20,21);5-7,20H,1-4H3,(H2,15,16,17,18,19);5-8H,1-4H3,(H2,14,15,16,18,20).
What are the key properties of 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea?
1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea has a molecular weight of 2354.72 g/mol, XLogP of 15.21, 25 rotatable bonds, 16 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopropyl-6-methylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-ditert-butylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea;1-(4,6-dimethylpyrimidin-2-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea;1-[2,4-dimethyl-6-(trifluoromethyl)phenyl]-3-[4-(2-hydroxypropan-2-yl)furan-2-yl]sulfonylurea is sourced from PubChem (CID 161247437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).