2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone

C141H147F2N17O9S2 — CID 160507486

IUPAC2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone
SMILESCOC(=O)C1CC(CC(=O)c2ccc3c(c2)C(c2ccnc(C)c2)=NC3)CN(Cc2c(F)cccc2OC)C1.COc1ccsc1CN1CCC[C@@H](CC(=O)c2ccc3c(c2)C(c2ccnc(C)c2)=NC3)C1.Cc1cc(C2=NCc3ccc(C(=O)C[C@@H]4CCCN(Cc5ncccc5F)C4)cc32)ccn1.Cc1cc(C2=NCc3ccc(C(=O)C[C@@H]4CCCN(Cc5scnc5C)C4)cc32)ccn1.[2H]C1(N2CCC[C@@H](CC(=O)c3ccc4c(c3)C(c3ccnc(C)c3)=NC4)C2)CCc2ccccc21
InChIInChI=1S/C31H32FN3O4.C30H31N3O.C27H27FN4O.C27H29N3O2S.C26H28N4OS/c1-19-11-22(9-10-33-19)30-25-14-21(7-8-23(25)15-34-30)28(36)13-20-12-24(31(37)39-3)17-35(16-20)18-26-27(32)5-4-6-29(26)38-2;1-20-15-24(12-13-31-20)30-27-17-23(8-9-25(27)18-32-30)29(34)16-21-5-4-14-33(19-21)28-11-10-22-6-2-3-7-26(22)28;1-18-12-21(8-10-29-18)27-23-14-20(6-7-22(23)15-31-27)26(33)13-19-4-3-11-32(16-19)17-25-24(28)5-2-9-30-25;1-18-12-21(7-9-28-18)27-23-14-20(5-6-22(23)15-29-27)24(31)13-19-4-3-10-30(16-19)17-26-25(32-2)8-11-33-26;1-17-10-21(7-8-27-17)26-23-12-20(5-6-22(23)13-28-26)24(31)11-19-4-3-9-30(14-19)15-25-18(2)29-16-32-25/h4-11,14,20,24H,12-13,15-18H2,1-3H3;2-3,6-9,12-13,15,17,21,28H,4-5,10-11,14,16,18-19H2,1H3;2,5-10,12,14,19H,3-4,11,13,15-17H2,1H3;5-9,11-12,14,19H,3-4,10,13,15-17H2,1-2H3;5-8,10,12,16,19H,3-4,9,11,13-15H2,1-2H3/t;21-,28?;3*19-/m.0000/s1/i;28D;;;
InChIKeyQSPHTSUNOMRCQW-OYNAEQBSSA-N
MW2326.97 g/mol
LogP25.53
Rot. Bonds32

About 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone

2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone (PubChem CID 160507486) has the molecular formula C141H147F2N17O9S2 and a molecular weight of 2326.97 g/mol. Its IUPAC name is 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone.

Molecular Properties

Compound Name2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone
PubChem CID160507486
Molecular FormulaC141H147F2N17O9S2
Molecular Weight2326.97 g/mol
Exact Mass2325.10
IUPAC Name2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone
SMILESCOC(=O)C1CC(CC(=O)c2ccc3c(c2)C(c2ccnc(C)c2)=NC3)CN(Cc2c(F)cccc2OC)C1.COc1ccsc1CN1CCC[C@@H](CC(=O)c2ccc3c(c2)C(c2ccnc(C)c2)=NC3)C1.Cc1cc(C2=NCc3ccc(C(=O)C[C@@H]4CCCN(Cc5ncccc5F)C4)cc32)ccn1.Cc1cc(C2=NCc3ccc(C(=O)C[C@@H]4CCCN(Cc5scnc5C)C4)cc32)ccn1.[2H]C1(N2CCC[C@@H](CC(=O)c3ccc4c(c3)C(c3ccnc(C)c3)=NC4)C2)CCc2ccccc21
InChIInChI=1S/C31H32FN3O4.C30H31N3O.C27H27FN4O.C27H29N3O2S.C26H28N4OS/c1-19-11-22(9-10-33-19)30-25-14-21(7-8-23(25)15-34-30)28(36)13-20-12-24(31(37)39-3)17-35(16-20)18-26-27(32)5-4-6-29(26)38-2;1-20-15-24(12-13-31-20)30-27-17-23(8-9-25(27)18-32-30)29(34)16-21-5-4-14-33(19-21)28-11-10-22-6-2-3-7-26(22)28;1-18-12-21(8-10-29-18)27-23-14-20(6-7-22(23)15-31-27)26(33)13-19-4-3-11-32(16-19)17-25-24(28)5-2-9-30-25;1-18-12-21(7-9-28-18)27-23-14-20(5-6-22(23)15-29-27)24(31)13-19-4-3-10-30(16-19)17-26-25(32-2)8-11-33-26;1-17-10-21(7-8-27-17)26-23-12-20(5-6-22(23)13-28-26)24(31)11-19-4-3-9-30(14-19)15-25-18(2)29-16-32-25/h4-11,14,20,24H,12-13,15-18H2,1-3H3;2-3,6-9,12-13,15,17,21,28H,4-5,10-11,14,16,18-19H2,1H3;2,5-10,12,14,19H,3-4,11,13,15-17H2,1H3;5-9,11-12,14,19H,3-4,10,13,15-17H2,1-2H3;5-8,10,12,16,19H,3-4,9,11,13-15H2,1-2H3/t;21-,28?;3*19-/m.0000/s1/i;28D;;;
InChIKeyQSPHTSUNOMRCQW-OYNAEQBSSA-N
XLogP25.53
TPSA298.34 Ų
H-Bond Donors
H-Bond Acceptors28
Rotatable Bonds32
Heavy Atoms171
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002326.97
LogP ≤ 525.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1028

Analyze 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone?
The IUPAC name of 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone (CID 160507486) is 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone.
What is the SMILES notation for 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone?
The canonical SMILES for 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone is COC(=O)C1CC(CC(=O)c2ccc3c(c2)C(c2ccnc(C)c2)=NC3)CN(Cc2c(F)cccc2OC)C1.COc1ccsc1CN1CCC[C@@H](CC(=O)c2ccc3c(c2)C(c2ccnc(C)c2)=NC3)C1.Cc1cc(C2=NCc3ccc(C(=O)C[C@@H]4CCCN(Cc5ncccc5F)C4)cc32)ccn1.Cc1cc(C2=NCc3ccc(C(=O)C[C@@H]4CCCN(Cc5scnc5C)C4)cc32)ccn1.[2H]C1(N2CCC[C@@H](CC(=O)c3ccc4c(c3)C(c3ccnc(C)c3)=NC4)C2)CCc2ccccc21.
What is the InChIKey of 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone?
The InChIKey is QSPHTSUNOMRCQW-OYNAEQBSSA-N. The full InChI is InChI=1S/C31H32FN3O4.C30H31N3O.C27H27FN4O.C27H29N3O2S.C26H28N4OS/c1-19-11-22(9-10-33-19)30-25-14-21(7-8-23(25)15-34-30)28(36)13-20-12-24(31(37)39-3)17-35(16-20)18-26-27(32)5-4-6-29(26)38-2;1-20-15-24(12-13-31-20)30-27-17-23(8-9-25(27)18-32-30)29(34)16-21-5-4-14-33(19-21)28-11-10-22-6-2-3-7-26(22)28;1-18-12-21(8-10-29-18)27-23-14-20(6-7-22(23)15-31-27)26(33)13-19-4-3-11-32(16-19)17-25-24(28)5-2-9-30-25;1-18-12-21(7-9-28-18)27-23-14-20(5-6-22(23)15-29-27)24(31)13-19-4-3-10-30(16-19)17-26-25(32-2)8-11-33-26;1-17-10-21(7-8-27-17)26-23-12-20(5-6-22(23)13-28-26)24(31)11-19-4-3-9-30(14-19)15-25-18(2)29-16-32-25/h4-11,14,20,24H,12-13,15-18H2,1-3H3;2-3,6-9,12-13,15,17,21,28H,4-5,10-11,14,16,18-19H2,1H3;2,5-10,12,14,19H,3-4,11,13,15-17H2,1H3;5-9,11-12,14,19H,3-4,10,13,15-17H2,1-2H3;5-8,10,12,16,19H,3-4,9,11,13-15H2,1-2H3/t;21-,28?;3*19-/m.0000/s1/i;28D;;;.
What are the key properties of 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone?
2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone has a molecular weight of 2326.97 g/mol, XLogP of 25.53, 32 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3S)-1-(1-deuterio-2,3-dihydroinden-1-yl)piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-fluoro-2-pyridinyl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;2-[(3S)-1-[(3-methoxythiophen-2-yl)methyl]piperidin-3-yl]-1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]ethanone;methyl 1-[(2-fluoro-6-methoxyphenyl)methyl]-5-[2-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-oxoethyl]piperidine-3-carboxylate;1-[3-(2-methyl-4-pyridinyl)-1H-isoindol-5-yl]-2-[(3S)-1-[(4-methyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]ethanone is sourced from PubChem (CID 160507486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).