N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide

C135H141F4N23O25S5 — CID 158446528

IUPACN-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide
SMILESCOC1(c2cc(S(=O)(=O)NC(=O)Cc3c(-c4ccnc(C)c4)cc(F)c4c3CCC4)nn2C2CC2)COC1.COC1(c2cc(S(=O)(=O)NC(=O)Cc3c(-c4ccnc(C)c4)cc(F)cc3C(C)C)nn2C2CC2)COC1.[C-]#[N+]c1cc(-c2cc(F)c3c(c2CC(=O)NS(=O)(=O)c2cc(C4(OC)COC4)n(C4CC4)n2)CCC3)ccn1.[C-]#[N+]c1cc(-c2cc(F)cc(C(C)C)c2CC(=O)NS(=O)(=O)c2cc(C3(OC)COC3)n(C3CC3)n2)ccn1.[C-]#[N+]c1cc(-c2ccc3c(c2CC(=O)NS(=O)(=O)c2cc(C4(OC)COC4)n(C4CC4)n2)CCC3)ccn1
InChIInChI=1S/C27H26FN5O5S.C27H28FN5O5S.C27H29FN4O5S.C27H31FN4O5S.C27H27N5O5S/c1-29-24-10-16(8-9-30-24)20-11-22(28)19-5-3-4-18(19)21(20)12-25(34)32-39(35,36)26-13-23(27(37-2)14-38-15-27)33(31-26)17-6-7-17;1-16(2)20-10-18(28)11-21(17-7-8-30-24(9-17)29-3)22(20)12-25(34)32-39(35,36)26-13-23(27(37-4)14-38-15-27)33(31-26)19-5-6-19;1-16-10-17(8-9-29-16)21-11-23(28)20-5-3-4-19(20)22(21)12-25(33)31-38(34,35)26-13-24(27(36-2)14-37-15-27)32(30-26)18-6-7-18;1-16(2)21-10-19(28)11-22(18-7-8-29-17(3)9-18)23(21)12-25(33)31-38(34,35)26-13-24(27(36-4)14-37-15-27)32(30-26)20-5-6-20;1-28-24-12-18(10-11-29-24)21-9-6-17-4-3-5-20(17)22(21)13-25(33)31-38(34,35)26-14-23(27(36-2)15-37-16-27)32(30-26)19-7-8-19/h8-11,13,17H,3-7,12,14-15H2,2H3,(H,32,34);7-11,13,16,19H,5-6,12,14-15H2,1-2,4H3,(H,32,34);8-11,13,18H,3-7,12,14-15H2,1-2H3,(H,31,33);7-11,13,16,20H,5-6,12,14-15H2,1-4H3,(H,31,33);6,9-12,14,19H,3-5,7-8,13,15-16H2,2H3,(H,31,33)
InChIKeyHDLOPJYOWVEFTN-UHFFFAOYSA-N
MW2722.08 g/mol
LogP17.54
Rot. Bonds42

About N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide

N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide (PubChem CID 158446528) has the molecular formula C135H141F4N23O25S5 and a molecular weight of 2722.08 g/mol. Its IUPAC name is N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide
PubChem CID158446528
Molecular FormulaC135H141F4N23O25S5
Molecular Weight2722.08 g/mol
Exact Mass2719.90
IUPAC NameN-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide
SMILESCOC1(c2cc(S(=O)(=O)NC(=O)Cc3c(-c4ccnc(C)c4)cc(F)c4c3CCC4)nn2C2CC2)COC1.COC1(c2cc(S(=O)(=O)NC(=O)Cc3c(-c4ccnc(C)c4)cc(F)cc3C(C)C)nn2C2CC2)COC1.[C-]#[N+]c1cc(-c2cc(F)c3c(c2CC(=O)NS(=O)(=O)c2cc(C4(OC)COC4)n(C4CC4)n2)CCC3)ccn1.[C-]#[N+]c1cc(-c2cc(F)cc(C(C)C)c2CC(=O)NS(=O)(=O)c2cc(C3(OC)COC3)n(C3CC3)n2)ccn1.[C-]#[N+]c1cc(-c2ccc3c(c2CC(=O)NS(=O)(=O)c2cc(C4(OC)COC4)n(C4CC4)n2)CCC3)ccn1
InChIInChI=1S/C27H26FN5O5S.C27H28FN5O5S.C27H29FN4O5S.C27H31FN4O5S.C27H27N5O5S/c1-29-24-10-16(8-9-30-24)20-11-22(28)19-5-3-4-18(19)21(20)12-25(34)32-39(35,36)26-13-23(27(37-2)14-38-15-27)33(31-26)17-6-7-17;1-16(2)20-10-18(28)11-21(17-7-8-30-24(9-17)29-3)22(20)12-25(34)32-39(35,36)26-13-23(27(37-4)14-38-15-27)33(31-26)19-5-6-19;1-16-10-17(8-9-29-16)21-11-23(28)20-5-3-4-19(20)22(21)12-25(33)31-38(34,35)26-13-24(27(36-2)14-37-15-27)32(30-26)18-6-7-18;1-16(2)21-10-19(28)11-22(18-7-8-29-17(3)9-18)23(21)12-25(33)31-38(34,35)26-13-24(27(36-4)14-37-15-27)32(30-26)20-5-6-20;1-28-24-12-18(10-11-29-24)21-9-6-17-4-3-5-20(17)22(21)13-25(33)31-38(34,35)26-14-23(27(36-2)15-37-16-27)32(30-26)19-7-8-19/h8-11,13,17H,3-7,12,14-15H2,2H3,(H,32,34);7-11,13,16,19H,5-6,12,14-15H2,1-2,4H3,(H,32,34);8-11,13,18H,3-7,12,14-15H2,1-2H3,(H,31,33);7-11,13,16,20H,5-6,12,14-15H2,1-4H3,(H,31,33);6,9-12,14,19H,3-5,7-8,13,15-16H2,2H3,(H,31,33)
InChIKeyHDLOPJYOWVEFTN-UHFFFAOYSA-N
XLogP17.54
TPSA575.13 Ų
H-Bond Donors5
H-Bond Acceptors40
Rotatable Bonds42
Heavy Atoms192
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002722.08
LogP ≤ 517.54
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

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

Analyze N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide?
The IUPAC name of N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide (CID 158446528) is N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide.
What is the SMILES notation for N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide?
The canonical SMILES for N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide is COC1(c2cc(S(=O)(=O)NC(=O)Cc3c(-c4ccnc(C)c4)cc(F)c4c3CCC4)nn2C2CC2)COC1.COC1(c2cc(S(=O)(=O)NC(=O)Cc3c(-c4ccnc(C)c4)cc(F)cc3C(C)C)nn2C2CC2)COC1.[C-]#[N+]c1cc(-c2cc(F)c3c(c2CC(=O)NS(=O)(=O)c2cc(C4(OC)COC4)n(C4CC4)n2)CCC3)ccn1.[C-]#[N+]c1cc(-c2cc(F)cc(C(C)C)c2CC(=O)NS(=O)(=O)c2cc(C3(OC)COC3)n(C3CC3)n2)ccn1.[C-]#[N+]c1cc(-c2ccc3c(c2CC(=O)NS(=O)(=O)c2cc(C4(OC)COC4)n(C4CC4)n2)CCC3)ccn1.
What is the InChIKey of N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide?
The InChIKey is HDLOPJYOWVEFTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26FN5O5S.C27H28FN5O5S.C27H29FN4O5S.C27H31FN4O5S.C27H27N5O5S/c1-29-24-10-16(8-9-30-24)20-11-22(28)19-5-3-4-18(19)21(20)12-25(34)32-39(35,36)26-13-23(27(37-2)14-38-15-27)33(31-26)17-6-7-17;1-16(2)20-10-18(28)11-21(17-7-8-30-24(9-17)29-3)22(20)12-25(34)32-39(35,36)26-13-23(27(37-4)14-38-15-27)33(31-26)19-5-6-19;1-16-10-17(8-9-29-16)21-11-23(28)20-5-3-4-19(20)22(21)12-25(33)31-38(34,35)26-13-24(27(36-2)14-37-15-27)32(30-26)18-6-7-18;1-16(2)21-10-19(28)11-22(18-7-8-29-17(3)9-18)23(21)12-25(33)31-38(34,35)26-13-24(27(36-4)14-37-15-27)32(30-26)20-5-6-20;1-28-24-12-18(10-11-29-24)21-9-6-17-4-3-5-20(17)22(21)13-25(33)31-38(34,35)26-14-23(27(36-2)15-37-16-27)32(30-26)19-7-8-19/h8-11,13,17H,3-7,12,14-15H2,2H3,(H,32,34);7-11,13,16,19H,5-6,12,14-15H2,1-2,4H3,(H,32,34);8-11,13,18H,3-7,12,14-15H2,1-2H3,(H,31,33);7-11,13,16,20H,5-6,12,14-15H2,1-4H3,(H,31,33);6,9-12,14,19H,3-5,7-8,13,15-16H2,2H3,(H,31,33).
What are the key properties of N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide?
N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide has a molecular weight of 2722.08 g/mol, XLogP of 17.54, 42 rotatable bonds, 5 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-isocyano-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[7-fluoro-5-(2-methyl-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[4-fluoro-2-(2-methyl-4-pyridinyl)-6-propan-2-ylphenyl]acetamide;N-[1-cyclopropyl-5-(3-methoxyoxetan-3-yl)pyrazol-3-yl]sulfonyl-2-[5-(2-isocyano-4-pyridinyl)-2,3-dihydro-1H-inden-4-yl]acetamide is sourced from PubChem (CID 158446528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).