4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide

C123H134Br3Cl2F17N10O20S5 — CID 157471609

IUPAC4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide
SMILESCS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3cc(F)c(Br)cc3F)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(Br)c(Cl)c3)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(Br)cc3C(F)(F)F)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(Cl)cc3C(F)(F)F)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(F)cc3C(F)(F)F)CC2)cc1F
InChIInChI=1S/C25H27BrF4N2O4S.C25H27ClF4N2O4S.C25H27F5N2O4S.C24H27BrClFN2O4S.C24H26BrF3N2O4S/c3*1-37(34,35)31-24(33)20-11-19(16-2-3-16)23(12-22(20)27)36-14-15-6-8-32(9-7-15)13-17-4-5-18(26)10-21(17)25(28,29)30;1-34(31,32)28-24(30)19-11-18(17-3-4-17)23(12-22(19)27)33-14-15-6-8-29(9-7-15)13-16-2-5-20(25)21(26)10-16;1-35(32,33)29-24(31)18-9-17(15-2-3-15)23(11-21(18)27)34-13-14-4-6-30(7-5-14)12-16-8-22(28)19(25)10-20(16)26/h3*4-5,10-12,15-16H,2-3,6-9,13-14H2,1H3,(H,31,33);2,5,10-12,15,17H,3-4,6-9,13-14H2,1H3,(H,28,30);8-11,14-15H,2-7,12-13H2,1H3,(H,29,31)
InChIKeyBVCIATATUNKXOP-UHFFFAOYSA-N
MW2866.39 g/mol
LogP25.49
Rot. Bonds40

About 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide

4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide (PubChem CID 157471609) has the molecular formula C123H134Br3Cl2F17N10O20S5 and a molecular weight of 2866.39 g/mol. Its IUPAC name is 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide.

Molecular Properties

Compound Name4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide
PubChem CID157471609
Molecular FormulaC123H134Br3Cl2F17N10O20S5
Molecular Weight2866.39 g/mol
Exact Mass2860.50
IUPAC Name4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide
SMILESCS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3cc(F)c(Br)cc3F)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(Br)c(Cl)c3)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(Br)cc3C(F)(F)F)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(Cl)cc3C(F)(F)F)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(F)cc3C(F)(F)F)CC2)cc1F
InChIInChI=1S/C25H27BrF4N2O4S.C25H27ClF4N2O4S.C25H27F5N2O4S.C24H27BrClFN2O4S.C24H26BrF3N2O4S/c3*1-37(34,35)31-24(33)20-11-19(16-2-3-16)23(12-22(20)27)36-14-15-6-8-32(9-7-15)13-17-4-5-18(26)10-21(17)25(28,29)30;1-34(31,32)28-24(30)19-11-18(17-3-4-17)23(12-22(19)27)33-14-15-6-8-29(9-7-15)13-16-2-5-20(25)21(26)10-16;1-35(32,33)29-24(31)18-9-17(15-2-3-15)23(11-21(18)27)34-13-14-4-6-30(7-5-14)12-16-8-22(28)19(25)10-20(16)26/h3*4-5,10-12,15-16H,2-3,6-9,13-14H2,1H3,(H,31,33);2,5,10-12,15,17H,3-4,6-9,13-14H2,1H3,(H,28,30);8-11,14-15H,2-7,12-13H2,1H3,(H,29,31)
InChIKeyBVCIATATUNKXOP-UHFFFAOYSA-N
XLogP25.49
TPSA378.55 Ų
H-Bond Donors5
H-Bond Acceptors25
Rotatable Bonds40
Heavy Atoms180
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002866.39
LogP ≤ 525.49
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Analyze 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide with MolForge

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Related Compounds

4-[[1-[[3-chloro-4-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide
CID 118110940
5-cyclopropyl-4-[[1-[(3,5-dichlorophenyl)methyl]piperidin-4-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide
CID 118111314
5-cyclopropyl-4-[[1-[(2,4-dichloro-5-fluorophenyl)methyl]piperidin-4-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide;2,2,2-trifluoroacetic acid
CID 118110846
5-cyclopropyl-2-fluoro-4-[[1-[[3-fluoro-4-(trifluoromethyl)phenyl]methyl]azetidin-3-yl]methoxy]-N-methylsulfonylbenzamide;molecular hydrogen
CID 144850456
4-[[1-[(4-chloro-3-fluorophenyl)methyl]azetidin-3-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide
CID 118111189
4-[[1-[(3-chloro-5-cyclopropyloxyphenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide
CID 122700254
4-[[1-[(1R)-1-(2-chloro-4-fluorophenyl)ethyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide
CID 118110607
5-cyclopropyl-2-fluoro-N-methylsulfonyl-4-[[1-[[3-(trifluoromethyl)-2-pyridinyl]methyl]piperidin-4-yl]methoxy]benzamide;2,2,2-trifluoroacetic acid
CID 118110672
5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N'-hydroxy-N'-methylsulfanylbenzohydrazide
CID 144850376
4-[[1-[(1R)-1-(2-chloro-4-fluorophenyl)ethyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(1S)-1-(2-chloro-4-fluorophenyl)ethyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-4-[[1-[(3,5-dichloro-2-fluorophenyl)methyl]piperidin-4-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-4-[[1-[(1R)-1-(2,4-dichlorophenyl)ethyl]piperidin-4-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-4-[[1-[(1S)-1-(2,4-dichlorophenyl)ethyl]piperidin-4-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-4-[[1-[(1R)-1-(3,5-dichlorophenyl)propyl]piperidin-4-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-4-[[1-[(1S)-1-(3,5-dichlorophenyl)propyl]piperidin-4-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide
CID 158299033
4-[[1-[(4-chloro-3-fluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[3-chloro-5-(trifluoromethoxy)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[3-chloro-5-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-4-[[1-[(3,5-dichlorophenyl)methyl]piperidin-4-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-4-[[1-[(R)-(3,5-dichlorophenyl)-phenylmethyl]azetidin-3-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-4-[[1-[(S)-(3,5-dichlorophenyl)-phenylmethyl]azetidin-3-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide
CID 162067376
5-cyclopropyl-4-[[1-[1-(2,4-dichlorophenyl)-2-methoxyethyl]piperidin-4-yl]methoxy]-2-fluoro-N-methylsulfonylbenzamide
CID 118110736

Frequently Asked Questions

What is the IUPAC name of 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide?
The IUPAC name of 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide (CID 157471609) is 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide.
What is the SMILES notation for 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide?
The canonical SMILES for 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide is CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3cc(F)c(Br)cc3F)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(Br)c(Cl)c3)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(Br)cc3C(F)(F)F)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(Cl)cc3C(F)(F)F)CC2)cc1F.CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCN(Cc3ccc(F)cc3C(F)(F)F)CC2)cc1F.
What is the InChIKey of 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide?
The InChIKey is BVCIATATUNKXOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27BrF4N2O4S.C25H27ClF4N2O4S.C25H27F5N2O4S.C24H27BrClFN2O4S.C24H26BrF3N2O4S/c3*1-37(34,35)31-24(33)20-11-19(16-2-3-16)23(12-22(20)27)36-14-15-6-8-32(9-7-15)13-17-4-5-18(26)10-21(17)25(28,29)30;1-34(31,32)28-24(30)19-11-18(17-3-4-17)23(12-22(19)27)33-14-15-6-8-29(9-7-15)13-16-2-5-20(25)21(26)10-16;1-35(32,33)29-24(31)18-9-17(15-2-3-15)23(11-21(18)27)34-13-14-4-6-30(7-5-14)12-16-8-22(28)19(25)10-20(16)26/h3*4-5,10-12,15-16H,2-3,6-9,13-14H2,1H3,(H,31,33);2,5,10-12,15,17H,3-4,6-9,13-14H2,1H3,(H,28,30);8-11,14-15H,2-7,12-13H2,1H3,(H,29,31).
What are the key properties of 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide?
4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide has a molecular weight of 2866.39 g/mol, XLogP of 25.49, 40 rotatable bonds, 5 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-[(4-bromo-3-chlorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[(4-bromo-2,5-difluorophenyl)methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-bromo-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;4-[[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-5-cyclopropyl-2-fluoro-N-methylsulfonylbenzamide;5-cyclopropyl-2-fluoro-4-[[1-[[4-fluoro-2-(trifluoromethyl)phenyl]methyl]piperidin-4-yl]methoxy]-N-methylsulfonylbenzamide is sourced from PubChem (CID 157471609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).