(4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate

C154H146Cl2N18O26 — CID 158310210

About (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate

(4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate (PubChem CID 158310210) has the molecular formula C154H146Cl2N18O26 and a molecular weight of 2735.87 g/mol. Its IUPAC name is (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate.

Molecular Properties

• Compound Name: (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate
• PubChem CID: 158310210
• Molecular Formula: C154H146Cl2N18O26
• Molecular Weight: 2735.87 g/mol
• Exact Mass: 2733.00
• IUPAC Name: (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate
• SMILES: CC[C@H](NC(=O)O[C@@H](c1ccccc1)c1cncc(Cl)c1)c1ccc(C(=O)Nc2ccccc2O)cc1.CC[C@H](OC(=O)N[C@@H](C)c1ccc(C(=O)Nc2ccccc2O)cc1)c1cccnc1.C[C@H](NC(=O)OC1(c2cccnc2)CCCC1)c1ccc(C(=O)Nc2ccccc2O)cc1.C[C@H](NC(=O)OCc1ccc(C(=O)O)cc1)c1ccc(C(=O)Nc2ccccc2O)cc1.O=C(N[C@@H](c1ccccc1)c1ccc(C(=O)Nc2ccccc2O)cc1)OCc1cnccc1Cl.O=C(N[C@]1(c2ccc(C(=O)Nc3ccccc3O)cc2)CCNC1)OCc1cccnc1
• InChI: InChI=1S/C29H26ClN3O4.C27H22ClN3O4.C26H27N3O4.C24H24N4O4.C24H25N3O4.C24H22N2O6/c1-2-24(19-12-14-21(15-13-19)28(35)32-25-10-6-7-11-26(25)34)33-29(36)37-27(20-8-4-3-5-9-20)22-16-23(30)18-31-17-22;28-22-14-15-29-16-21(22)17-35-27(34)31-25(18-6-2-1-3-7-18)19-10-12-20(13-11-19)26(33)30-23-8-4-5-9-24(23)32;1-18(28-25(32)33-26(14-4-5-15-26)21-7-6-16-27-17-21)19-10-12-20(13-11-19)24(31)29-22-8-2-3-9-23(22)30;29-21-6-2-1-5-20(21)27-22(30)18-7-9-19(10-8-18)24(11-13-26-16-24)28-23(31)32-15-17-4-3-12-25-14-17;1-3-22(19-7-6-14-25-15-19)31-24(30)26-16(2)17-10-12-18(13-11-17)23(29)27-20-8-4-5-9-21(20)28;1-15(25-24(31)32-14-16-6-8-19(9-7-16)23(29)30)17-10-12-18(13-11-17)22(28)26-20-4-2-3-5-21(20)27/h3-18,24,27,34H,2H2,1H3,(H,32,35)(H,33,36);1-16,25,32H,17H2,(H,30,33)(H,31,34);2-3,6-13,16-18,30H,4-5,14-15H2,1H3,(H,28,32)(H,29,31);1-10,12,14,26,29H,11,13,15-16H2,(H,27,30)(H,28,31);4-16,22,28H,3H2,1-2H3,(H,26,30)(H,27,29);2-13,15,27H,14H2,1H3,(H,25,31)(H,26,28)(H,29,30)/t24-,27-;25-;18-;24-;16-,22-;15-/m000100/s1
• InChIKey: GNOZLECIRLJECU-RSSATZFXSA-N
• XLogP: 30.13
• TPSA: 639.74 Ų
• H-Bond Donors: 20
• H-Bond Acceptors: 31
• Rotatable Bonds: 41
• Heavy Atoms: 200
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2735.87
LogP ≤ 5	30.13
H-Bond Donors ≤ 5	20
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate?

The IUPAC name of (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate (CID 158310210) is (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate.

What is the SMILES notation for (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate?

The canonical SMILES for (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate is CC[C@H](NC(=O)O[C@@H](c1ccccc1)c1cncc(Cl)c1)c1ccc(C(=O)Nc2ccccc2O)cc1.CC[C@H](OC(=O)N[C@@H](C)c1ccc(C(=O)Nc2ccccc2O)cc1)c1cccnc1.C[C@H](NC(=O)OC1(c2cccnc2)CCCC1)c1ccc(C(=O)Nc2ccccc2O)cc1.C[C@H](NC(=O)OCc1ccc(C(=O)O)cc1)c1ccc(C(=O)Nc2ccccc2O)cc1.O=C(N[C@@H](c1ccccc1)c1ccc(C(=O)Nc2ccccc2O)cc1)OCc1cnccc1Cl.O=C(N[C@]1(c2ccc(C(=O)Nc3ccccc3O)cc2)CCNC1)OCc1cccnc1.

What is the InChIKey of (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate?

The InChIKey is GNOZLECIRLJECU-RSSATZFXSA-N. The full InChI is InChI=1S/C29H26ClN3O4.C27H22ClN3O4.C26H27N3O4.C24H24N4O4.C24H25N3O4.C24H22N2O6/c1-2-24(19-12-14-21(15-13-19)28(35)32-25-10-6-7-11-26(25)34)33-29(36)37-27(20-8-4-3-5-9-20)22-16-23(30)18-31-17-22;28-22-14-15-29-16-21(22)17-35-27(34)31-25(18-6-2-1-3-7-18)19-10-12-20(13-11-19)26(33)30-23-8-4-5-9-24(23)32;1-18(28-25(32)33-26(14-4-5-15-26)21-7-6-16-27-17-21)19-10-12-20(13-11-19)24(31)29-22-8-2-3-9-23(22)30;29-21-6-2-1-5-20(21)27-22(30)18-7-9-19(10-8-18)24(11-13-26-16-24)28-23(31)32-15-17-4-3-12-25-14-17;1-3-22(19-7-6-14-25-15-19)31-24(30)26-16(2)17-10-12-18(13-11-17)23(29)27-20-8-4-5-9-21(20)28;1-15(25-24(31)32-14-16-6-8-19(9-7-16)23(29)30)17-10-12-18(13-11-17)22(28)26-20-4-2-3-5-21(20)27/h3-18,24,27,34H,2H2,1H3,(H,32,35)(H,33,36);1-16,25,32H,17H2,(H,30,33)(H,31,34);2-3,6-13,16-18,30H,4-5,14-15H2,1H3,(H,28,32)(H,29,31);1-10,12,14,26,29H,11,13,15-16H2,(H,27,30)(H,28,31);4-16,22,28H,3H2,1-2H3,(H,26,30)(H,27,29);2-13,15,27H,14H2,1H3,(H,25,31)(H,26,28)(H,29,30)/t24-,27-;25-;18-;24-;16-,22-;15-/m000100/s1.

What are the key properties of (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate?

(4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate has a molecular weight of 2735.87 g/mol, XLogP of 30.13, 41 rotatable bonds, 20 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for (4-chloro-3-pyridinyl)methyl N-[(S)-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]-phenylmethyl]carbamate;[(S)-(5-chloro-3-pyridinyl)-phenylmethyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]propyl]carbamate;4-[[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamoyloxymethyl]benzoic acid;(1-pyridin-3-ylcyclopentyl) N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate;pyridin-3-ylmethyl N-[(3S)-3-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]pyrrolidin-3-yl]carbamate;[(1S)-1-pyridin-3-ylpropyl] N-[(1S)-1-[4-[(2-hydroxyphenyl)carbamoyl]phenyl]ethyl]carbamate is sourced from PubChem (CID 158310210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).