[3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile

C141H129F10N27O6 — CID 159328641

IUPAC[3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile
SMILESCc1ccc2nn(CC34CC(C(=O)N5N=CCC5c5cc(F)cc(F)c5)(C3)C4)nc2c1.Cc1cccc2c1cnn2CC12CC(C(=O)N3CC(F)CC3c3cccc(F)c3)(C1)C2.Cc1cccc2c1cnn2CC12CC(C(=O)N3N=CCC3c3cc(F)ccc3F)(C1)C2.Cc1cccc2c1cnn2CC12CC(C(=O)N3N=CCC3c3cccc(C#N)c3)(C1)C2.O=C(N1N=CCC1c1cc(F)cc(F)c1)C12CC(Cn3nc4ccccc4n3)(C1)C2.O=C(N1N=CCC1c1cc(F)cc(F)c1)C12CC(Cn3ncc4ccncc43)(C1)C2
InChIInChI=1S/C25H25F2N3O.C25H23N5O.C24H22F2N4O.C23H21F2N5O.2C22H19F2N5O/c1-16-4-2-7-21-20(16)10-28-30(21)15-24-12-25(13-24,14-24)23(31)29-11-19(27)9-22(29)17-5-3-6-18(26)8-17;1-17-4-2-7-22-20(17)12-28-29(22)16-24-13-25(14-24,15-24)23(31)30-21(8-9-27-30)19-6-3-5-18(10-19)11-26;1-15-3-2-4-20-18(15)10-28-29(20)14-23-11-24(12-23,13-23)22(31)30-21(7-8-27-30)17-9-16(25)5-6-19(17)26;1-14-2-3-18-19(6-14)28-29(27-18)13-22-10-23(11-22,12-22)21(31)30-20(4-5-26-30)15-7-16(24)9-17(25)8-15;23-16-5-15(6-17(24)7-16)18-2-4-26-29(18)20(30)22-10-21(11-22,12-22)13-28-19-9-25-3-1-14(19)8-27-28;23-15-7-14(8-16(24)9-15)19-5-6-25-29(19)20(30)22-10-21(11-22,12-22)13-28-26-17-3-1-2-4-18(17)27-28/h2-8,10,19,22H,9,11-15H2,1H3;2-7,9-10,12,21H,8,13-16H2,1H3;2-6,8-10,21H,7,11-14H2,1H3;2-3,5-9,20H,4,10-13H2,1H3;1,3-9,18H,2,10-13H2;1-4,6-9,19H,5,10-13H2
InChIKeyLERRINCJNOVKTR-UHFFFAOYSA-N
MW2487.75 g/mol
LogP25.89
Rot. Bonds24

About [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile

[3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile (PubChem CID 159328641) has the molecular formula C141H129F10N27O6 and a molecular weight of 2487.75 g/mol. Its IUPAC name is [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile.

Molecular Properties

Compound Name[3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile
PubChem CID159328641
Molecular FormulaC141H129F10N27O6
Molecular Weight2487.75 g/mol
Exact Mass2486.05
IUPAC Name[3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile
SMILESCc1ccc2nn(CC34CC(C(=O)N5N=CCC5c5cc(F)cc(F)c5)(C3)C4)nc2c1.Cc1cccc2c1cnn2CC12CC(C(=O)N3CC(F)CC3c3cccc(F)c3)(C1)C2.Cc1cccc2c1cnn2CC12CC(C(=O)N3N=CCC3c3cc(F)ccc3F)(C1)C2.Cc1cccc2c1cnn2CC12CC(C(=O)N3N=CCC3c3cccc(C#N)c3)(C1)C2.O=C(N1N=CCC1c1cc(F)cc(F)c1)C12CC(Cn3nc4ccccc4n3)(C1)C2.O=C(N1N=CCC1c1cc(F)cc(F)c1)C12CC(Cn3ncc4ccncc43)(C1)C2
InChIInChI=1S/C25H25F2N3O.C25H23N5O.C24H22F2N4O.C23H21F2N5O.2C22H19F2N5O/c1-16-4-2-7-21-20(16)10-28-30(21)15-24-12-25(13-24,14-24)23(31)29-11-19(27)9-22(29)17-5-3-6-18(26)8-17;1-17-4-2-7-22-20(17)12-28-29(22)16-24-13-25(14-24,15-24)23(31)30-21(8-9-27-30)19-6-3-5-18(10-19)11-26;1-15-3-2-4-20-18(15)10-28-29(20)14-23-11-24(12-23,13-23)22(31)30-21(7-8-27-30)17-9-16(25)5-6-19(17)26;1-14-2-3-18-19(6-14)28-29(27-18)13-22-10-23(11-22,12-22)21(31)30-20(4-5-26-30)15-7-16(24)9-17(25)8-15;23-16-5-15(6-17(24)7-16)18-2-4-26-29(18)20(30)22-10-21(11-22,12-22)13-28-19-9-25-3-1-14(19)8-27-28;23-15-7-14(8-16(24)9-15)19-5-6-25-29(19)20(30)22-10-21(11-22,12-22)13-28-26-17-3-1-2-4-18(17)27-28/h2-8,10,19,22H,9,11-15H2,1H3;2-7,9-10,12,21H,8,13-16H2,1H3;2-6,8-10,21H,7,11-14H2,1H3;2-3,5-9,20H,4,10-13H2,1H3;1,3-9,18H,2,10-13H2;1-4,6-9,19H,5,10-13H2
InChIKeyLERRINCJNOVKTR-UHFFFAOYSA-N
XLogP25.89
TPSA353.04 Ų
H-Bond Donors
H-Bond Acceptors27
Rotatable Bonds24
Heavy Atoms184
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002487.75
LogP ≤ 525.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1027

Analyze [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile?
The IUPAC name of [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile (CID 159328641) is [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile.
What is the SMILES notation for [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile?
The canonical SMILES for [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile is Cc1ccc2nn(CC34CC(C(=O)N5N=CCC5c5cc(F)cc(F)c5)(C3)C4)nc2c1.Cc1cccc2c1cnn2CC12CC(C(=O)N3CC(F)CC3c3cccc(F)c3)(C1)C2.Cc1cccc2c1cnn2CC12CC(C(=O)N3N=CCC3c3cc(F)ccc3F)(C1)C2.Cc1cccc2c1cnn2CC12CC(C(=O)N3N=CCC3c3cccc(C#N)c3)(C1)C2.O=C(N1N=CCC1c1cc(F)cc(F)c1)C12CC(Cn3nc4ccccc4n3)(C1)C2.O=C(N1N=CCC1c1cc(F)cc(F)c1)C12CC(Cn3ncc4ccncc43)(C1)C2.
What is the InChIKey of [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile?
The InChIKey is LERRINCJNOVKTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25F2N3O.C25H23N5O.C24H22F2N4O.C23H21F2N5O.2C22H19F2N5O/c1-16-4-2-7-21-20(16)10-28-30(21)15-24-12-25(13-24,14-24)23(31)29-11-19(27)9-22(29)17-5-3-6-18(26)8-17;1-17-4-2-7-22-20(17)12-28-29(22)16-24-13-25(14-24,15-24)23(31)30-21(8-9-27-30)19-6-3-5-18(10-19)11-26;1-15-3-2-4-20-18(15)10-28-29(20)14-23-11-24(12-23,13-23)22(31)30-21(7-8-27-30)17-9-16(25)5-6-19(17)26;1-14-2-3-18-19(6-14)28-29(27-18)13-22-10-23(11-22,12-22)21(31)30-20(4-5-26-30)15-7-16(24)9-17(25)8-15;23-16-5-15(6-17(24)7-16)18-2-4-26-29(18)20(30)22-10-21(11-22,12-22)13-28-19-9-25-3-1-14(19)8-27-28;23-15-7-14(8-16(24)9-15)19-5-6-25-29(19)20(30)22-10-21(11-22,12-22)13-28-26-17-3-1-2-4-18(17)27-28/h2-8,10,19,22H,9,11-15H2,1H3;2-7,9-10,12,21H,8,13-16H2,1H3;2-6,8-10,21H,7,11-14H2,1H3;2-3,5-9,20H,4,10-13H2,1H3;1,3-9,18H,2,10-13H2;1-4,6-9,19H,5,10-13H2.
What are the key properties of [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile?
[3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile has a molecular weight of 2487.75 g/mol, XLogP of 25.89, 24 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(benzotriazol-2-ylmethyl)-1-bicyclo[1.1.1]pentanyl]-[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(5-methylbenzotriazol-2-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(2,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;[3-(3,5-difluorophenyl)-3,4-dihydropyrazol-2-yl]-[3-(pyrazolo[5,4-c]pyridin-1-ylmethyl)-1-bicyclo[1.1.1]pentanyl]methanone;[4-fluoro-2-(3-fluorophenyl)pyrrolidin-1-yl]-[3-[(4-methylindazol-1-yl)methyl]-1-bicyclo[1.1.1]pentanyl]methanone;3-[2-[3-[(4-methylindazol-1-yl)methyl]bicyclo[1.1.1]pentane-1-carbonyl]-3,4-dihydropyrazol-3-yl]benzonitrile is sourced from PubChem (CID 159328641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).