5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol

C121H121Br2ClN6O10 — CID 158134179

About 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol

5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol (PubChem CID 158134179) has the molecular formula C121H121Br2ClN6O10 and a molecular weight of 2014.59 g/mol. Its IUPAC name is 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol.

Molecular Properties

• Compound Name: 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol
• PubChem CID: 158134179
• Molecular Formula: C121H121Br2ClN6O10
• Molecular Weight: 2014.59 g/mol
• Exact Mass: 2010.72
• IUPAC Name: 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol
• SMILES: Brc1ccc(Oc2ccc([C@@H]3c4ccc(OCc5ccccc5)cc4CC[C@@H]3c3ccccc3)cc2)nc1.CC(C)(C)OC(=O)N1CCCCC1.CC(C)(C)OC(=O)N1CCN(c2ccc(Oc3ccc([C@@H]4c5ccc(OCc6ccccc6)cc5CC[C@@H]4c4ccccc4)cc3)nc2)CC1.Clc1ccc(Br)cn1.Oc1ccc([C@@H]2c3ccc(OCc4ccccc4)cc3CC[C@@H]2c2ccccc2)cc1
• InChI: InChI=1S/C43H45N3O4.C34H28BrNO2.C29H26O2.C10H19NO2.C5H3BrClN/c1-43(2,3)50-42(47)46-26-24-45(25-27-46)35-17-23-40(44-29-35)49-36-18-14-33(15-19-36)41-38(32-12-8-5-9-13-32)21-16-34-28-37(20-22-39(34)41)48-30-31-10-6-4-7-11-31;35-28-14-20-33(36-22-28)38-29-15-11-26(12-16-29)34-31(25-9-5-2-6-10-25)18-13-27-21-30(17-19-32(27)34)37-23-24-7-3-1-4-8-24;30-25-14-11-23(12-15-25)29-27(22-9-5-2-6-10-22)17-13-24-19-26(16-18-28(24)29)31-20-21-7-3-1-4-8-21;1-10(2,3)13-9(12)11-7-5-4-6-8-11;6-4-1-2-5(7)8-3-4/h4-15,17-20,22-23,28-29,38,41H,16,21,24-27,30H2,1-3H3;1-12,14-17,19-22,31,34H,13,18,23H2;1-12,14-16,18-19,27,29-30H,13,17,20H2;4-8H2,1-3H3;1-3H/t38-,41+;31-,34+;27-,29+;;/m111../s1
• InChIKey: FTDJWNWQUABRNF-SWPCMFTPSA-N
• XLogP: 30.19
• TPSA: 167.37 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 20
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2014.59
LogP ≤ 5	30.19
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol?

The IUPAC name of 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol (CID 158134179) is 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol.

What is the SMILES notation for 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol?

The canonical SMILES for 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol is Brc1ccc(Oc2ccc([C@@H]3c4ccc(OCc5ccccc5)cc4CC[C@@H]3c3ccccc3)cc2)nc1.CC(C)(C)OC(=O)N1CCCCC1.CC(C)(C)OC(=O)N1CCN(c2ccc(Oc3ccc([C@@H]4c5ccc(OCc6ccccc6)cc5CC[C@@H]4c4ccccc4)cc3)nc2)CC1.Clc1ccc(Br)cn1.Oc1ccc([C@@H]2c3ccc(OCc4ccccc4)cc3CC[C@@H]2c2ccccc2)cc1.

What is the InChIKey of 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol?

The InChIKey is FTDJWNWQUABRNF-SWPCMFTPSA-N. The full InChI is InChI=1S/C43H45N3O4.C34H28BrNO2.C29H26O2.C10H19NO2.C5H3BrClN/c1-43(2,3)50-42(47)46-26-24-45(25-27-46)35-17-23-40(44-29-35)49-36-18-14-33(15-19-36)41-38(32-12-8-5-9-13-32)21-16-34-28-37(20-22-39(34)41)48-30-31-10-6-4-7-11-31;35-28-14-20-33(36-22-28)38-29-15-11-26(12-16-29)34-31(25-9-5-2-6-10-25)18-13-27-21-30(17-19-32(27)34)37-23-24-7-3-1-4-8-24;30-25-14-11-23(12-15-25)29-27(22-9-5-2-6-10-22)17-13-24-19-26(16-18-28(24)29)31-20-21-7-3-1-4-8-21;1-10(2,3)13-9(12)11-7-5-4-6-8-11;6-4-1-2-5(7)8-3-4/h4-15,17-20,22-23,28-29,38,41H,16,21,24-27,30H2,1-3H3;1-12,14-17,19-22,31,34H,13,18,23H2;1-12,14-16,18-19,27,29-30H,13,17,20H2;4-8H2,1-3H3;1-3H/t38-,41+;31-,34+;27-,29+;;/m111../s1.

What are the key properties of 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol?

5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol has a molecular weight of 2014.59 g/mol, XLogP of 30.19, 20 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-2-chloropyridine;5-bromo-2-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]pyridine;tert-butyl 4-[6-[4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenoxy]-3-pyridinyl]piperazine-1-carboxylate;tert-butyl piperidine-1-carboxylate;4-[(1R,2S)-2-phenyl-6-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-yl]phenol is sourced from PubChem (CID 158134179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).