2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate

C152H158F5N27O12 — CID 167670255

IUPAC2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate
SMILESCC(C)(O)OC(=O)N1CCCCC1Cc1[nH]n(-c2nc3ccccc3[nH]2)c(=O)c1CCc1ccc(F)cc1.O=C(OCc1ccccc1)N1CCC(Cc2[nH]n(-c3nc4ccccc4[nH]3)c(=O)c2CCc2ccc(F)cc2)CC1.O=C(OCc1ccccc1)N1CCCC(Cc2[nH]n(-c3nc4ccccc4[nH]3)c(=O)c2CCc2ccc(F)cc2)C1.O=c1c(CCc2ccc(F)cc2)c(CC2CCN(Cc3cccnc3)CC2)[nH]n1-c1nc2ccccc2[nH]1.O=c1c(CCc2ccc(F)cc2)c(CC2CCN(Cc3ccncc3)CC2)[nH]n1-c1nc2ccccc2[nH]1
InChIInChI=1S/2C32H32FN5O3.2C30H31FN6O.C28H32FN5O4/c33-25-15-12-22(13-16-25)14-17-26-29(36-38(30(26)39)31-34-27-10-4-5-11-28(27)35-31)19-24-9-6-18-37(20-24)32(40)41-21-23-7-2-1-3-8-23;33-25-13-10-22(11-14-25)12-15-26-29(36-38(30(26)39)31-34-27-8-4-5-9-28(27)35-31)20-23-16-18-37(19-17-23)32(40)41-21-24-6-2-1-3-7-24;31-24-10-7-21(8-11-24)9-12-25-28(18-22-13-16-36(17-14-22)20-23-4-3-15-32-19-23)35-37(29(25)38)30-33-26-5-1-2-6-27(26)34-30;31-24-8-5-21(6-9-24)7-10-25-28(19-22-13-17-36(18-14-22)20-23-11-15-32-16-12-23)35-37(29(25)38)30-33-26-3-1-2-4-27(26)34-30;1-28(2,37)38-27(36)33-16-6-5-7-20(33)17-24-21(15-12-18-10-13-19(29)14-11-18)25(35)34(32-24)26-30-22-8-3-4-9-23(22)31-26/h1-5,7-8,10-13,15-16,24,36H,6,9,14,17-21H2,(H,34,35);1-11,13-14,23,36H,12,15-21H2,(H,34,35);1-8,10-11,15,19,22,35H,9,12-14,16-18,20H2,(H,33,34);1-6,8-9,11-12,15-16,22,35H,7,10,13-14,17-20H2,(H,33,34);3-4,8-11,13-14,20,32,37H,5-7,12,15-17H2,1-2H3,(H,30,31)
InChIKeyCBYHNTSLCXEOQN-UHFFFAOYSA-N
MW2650.10 g/mol
LogP24.98
Rot. Bonds39

About 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate

2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate (PubChem CID 167670255) has the molecular formula C152H158F5N27O12 and a molecular weight of 2650.10 g/mol. Its IUPAC name is 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate.

Molecular Properties

Compound Name2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate
PubChem CID167670255
Molecular FormulaC152H158F5N27O12
Molecular Weight2650.10 g/mol
Exact Mass2648.25
IUPAC Name2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate
SMILESCC(C)(O)OC(=O)N1CCCCC1Cc1[nH]n(-c2nc3ccccc3[nH]2)c(=O)c1CCc1ccc(F)cc1.O=C(OCc1ccccc1)N1CCC(Cc2[nH]n(-c3nc4ccccc4[nH]3)c(=O)c2CCc2ccc(F)cc2)CC1.O=C(OCc1ccccc1)N1CCCC(Cc2[nH]n(-c3nc4ccccc4[nH]3)c(=O)c2CCc2ccc(F)cc2)C1.O=c1c(CCc2ccc(F)cc2)c(CC2CCN(Cc3cccnc3)CC2)[nH]n1-c1nc2ccccc2[nH]1.O=c1c(CCc2ccc(F)cc2)c(CC2CCN(Cc3ccncc3)CC2)[nH]n1-c1nc2ccccc2[nH]1
InChIInChI=1S/2C32H32FN5O3.2C30H31FN6O.C28H32FN5O4/c33-25-15-12-22(13-16-25)14-17-26-29(36-38(30(26)39)31-34-27-10-4-5-11-28(27)35-31)19-24-9-6-18-37(20-24)32(40)41-21-23-7-2-1-3-8-23;33-25-13-10-22(11-14-25)12-15-26-29(36-38(30(26)39)31-34-27-8-4-5-9-28(27)35-31)20-23-16-18-37(19-17-23)32(40)41-21-24-6-2-1-3-7-24;31-24-10-7-21(8-11-24)9-12-25-28(18-22-13-16-36(17-14-22)20-23-4-3-15-32-19-23)35-37(29(25)38)30-33-26-5-1-2-6-27(26)34-30;31-24-8-5-21(6-9-24)7-10-25-28(19-22-13-17-36(18-14-22)20-23-11-15-32-16-12-23)35-37(29(25)38)30-33-26-3-1-2-4-27(26)34-30;1-28(2,37)38-27(36)33-16-6-5-7-20(33)17-24-21(15-12-18-10-13-19(29)14-11-18)25(35)34(32-24)26-30-22-8-3-4-9-23(22)31-26/h1-5,7-8,10-13,15-16,24,36H,6,9,14,17-21H2,(H,34,35);1-11,13-14,23,36H,12,15-21H2,(H,34,35);1-8,10-11,15,19,22,35H,9,12-14,16-18,20H2,(H,33,34);1-6,8-9,11-12,15-16,22,35H,7,10,13-14,17-20H2,(H,33,34);3-4,8-11,13-14,20,32,37H,5-7,12,15-17H2,1-2H3,(H,30,31)
InChIKeyCBYHNTSLCXEOQN-UHFFFAOYSA-N
XLogP24.98
TPSA473.46 Ų
H-Bond Donors11
H-Bond Acceptors26
Rotatable Bonds39
Heavy Atoms196
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002650.10
LogP ≤ 524.98
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate?
The IUPAC name of 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate (CID 167670255) is 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate.
What is the SMILES notation for 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate?
The canonical SMILES for 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate is CC(C)(O)OC(=O)N1CCCCC1Cc1[nH]n(-c2nc3ccccc3[nH]2)c(=O)c1CCc1ccc(F)cc1.O=C(OCc1ccccc1)N1CCC(Cc2[nH]n(-c3nc4ccccc4[nH]3)c(=O)c2CCc2ccc(F)cc2)CC1.O=C(OCc1ccccc1)N1CCCC(Cc2[nH]n(-c3nc4ccccc4[nH]3)c(=O)c2CCc2ccc(F)cc2)C1.O=c1c(CCc2ccc(F)cc2)c(CC2CCN(Cc3cccnc3)CC2)[nH]n1-c1nc2ccccc2[nH]1.O=c1c(CCc2ccc(F)cc2)c(CC2CCN(Cc3ccncc3)CC2)[nH]n1-c1nc2ccccc2[nH]1.
What is the InChIKey of 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate?
The InChIKey is CBYHNTSLCXEOQN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C32H32FN5O3.2C30H31FN6O.C28H32FN5O4/c33-25-15-12-22(13-16-25)14-17-26-29(36-38(30(26)39)31-34-27-10-4-5-11-28(27)35-31)19-24-9-6-18-37(20-24)32(40)41-21-23-7-2-1-3-8-23;33-25-13-10-22(11-14-25)12-15-26-29(36-38(30(26)39)31-34-27-8-4-5-9-28(27)35-31)20-23-16-18-37(19-17-23)32(40)41-21-24-6-2-1-3-7-24;31-24-10-7-21(8-11-24)9-12-25-28(18-22-13-16-36(17-14-22)20-23-4-3-15-32-19-23)35-37(29(25)38)30-33-26-5-1-2-6-27(26)34-30;31-24-8-5-21(6-9-24)7-10-25-28(19-22-13-17-36(18-14-22)20-23-11-15-32-16-12-23)35-37(29(25)38)30-33-26-3-1-2-4-27(26)34-30;1-28(2,37)38-27(36)33-16-6-5-7-20(33)17-24-21(15-12-18-10-13-19(29)14-11-18)25(35)34(32-24)26-30-22-8-3-4-9-23(22)31-26/h1-5,7-8,10-13,15-16,24,36H,6,9,14,17-21H2,(H,34,35);1-11,13-14,23,36H,12,15-21H2,(H,34,35);1-8,10-11,15,19,22,35H,9,12-14,16-18,20H2,(H,33,34);1-6,8-9,11-12,15-16,22,35H,7,10,13-14,17-20H2,(H,33,34);3-4,8-11,13-14,20,32,37H,5-7,12,15-17H2,1-2H3,(H,30,31).
What are the key properties of 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate?
2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate has a molecular weight of 2650.10 g/mol, XLogP of 24.98, 39 rotatable bonds, 11 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-3-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-5-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methyl]-1H-pyrazol-3-one;benzyl 3-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;benzyl 4-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate;2-hydroxypropan-2-yl 2-[[2-(1H-benzimidazol-2-yl)-4-[2-(4-fluorophenyl)ethyl]-3-oxo-1H-pyrazol-5-yl]methyl]piperidine-1-carboxylate is sourced from PubChem (CID 167670255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).