ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate

C115H105Cl5N20O20S5 — CID 157233684

About ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate

ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate (PubChem CID 157233684) has the molecular formula C115H105Cl5N20O20S5 and a molecular weight of 2424.82 g/mol. Its IUPAC name is ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate.

Molecular Properties

• Compound Name: ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate
• PubChem CID: 157233684
• Molecular Formula: C115H105Cl5N20O20S5
• Molecular Weight: 2424.82 g/mol
• Exact Mass: 2420.49
• IUPAC Name: ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate
• SMILES: CCOC(=O)N(C)c1ccn2c(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.CCOC(=O)Nc1ccn2c(-c3cc(O[C@@H](C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.CC[C@H](Oc1cc(-c2cnc3cc(NC(=O)OC)ccn23)sc1C(N)=O)c1ccccc1Cl.COC(=O)N(C)c1ccn2c(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.COC(=O)Nc1ccn2c(-c3cc(O[C@@H](C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1
• InChI: InChI=1S/C24H23ClN4O4S.3C23H21ClN4O4S.C22H19ClN4O4S/c1-4-32-24(31)28(3)15-9-10-29-18(13-27-21(29)11-15)20-12-19(22(34-20)23(26)30)33-14(2)16-7-5-6-8-17(16)25;1-13(15-6-4-5-7-16(15)24)32-18-11-19(33-21(18)22(25)29)17-12-26-20-10-14(8-9-28(17)20)27(2)23(30)31-3;1-3-17(14-6-4-5-7-15(14)24)32-18-11-19(33-21(18)22(25)29)16-12-26-20-10-13(8-9-28(16)20)27-23(30)31-2;1-3-31-23(30)27-14-8-9-28-17(12-26-20(28)10-14)19-11-18(21(33-19)22(25)29)32-13(2)15-6-4-5-7-16(15)24;1-12(14-5-3-4-6-15(14)23)31-17-10-18(32-20(17)21(24)28)16-11-25-19-9-13(7-8-27(16)19)26-22(29)30-2/h5-14H,4H2,1-3H3,(H2,26,30);4-13H,1-3H3,(H2,25,29);4-12,17H,3H2,1-2H3,(H2,25,29)(H,27,30);4-13H,3H2,1-2H3,(H2,25,29)(H,27,30);3-12H,1-2H3,(H2,24,28)(H,26,29)/t;;17-;13-;12-/m..000/s1
• InChIKey: AUJSYTHOGYYRSV-OTCVIMFTSA-N
• XLogP: 26.89
• TPSA: 522.17 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 35
• Rotatable Bonds: 33
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2424.82
LogP ≤ 5	26.89
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate?

The IUPAC name of ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate (CID 157233684) is ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate.

What is the SMILES notation for ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate?

The canonical SMILES for ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate is CCOC(=O)N(C)c1ccn2c(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.CCOC(=O)Nc1ccn2c(-c3cc(O[C@@H](C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.CC[C@H](Oc1cc(-c2cnc3cc(NC(=O)OC)ccn23)sc1C(N)=O)c1ccccc1Cl.COC(=O)N(C)c1ccn2c(-c3cc(OC(C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.COC(=O)Nc1ccn2c(-c3cc(O[C@@H](C)c4ccccc4Cl)c(C(N)=O)s3)cnc2c1.

What is the InChIKey of ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate?

The InChIKey is AUJSYTHOGYYRSV-OTCVIMFTSA-N. The full InChI is InChI=1S/C24H23ClN4O4S.3C23H21ClN4O4S.C22H19ClN4O4S/c1-4-32-24(31)28(3)15-9-10-29-18(13-27-21(29)11-15)20-12-19(22(34-20)23(26)30)33-14(2)16-7-5-6-8-17(16)25;1-13(15-6-4-5-7-16(15)24)32-18-11-19(33-21(18)22(25)29)17-12-26-20-10-14(8-9-28(17)20)27(2)23(30)31-3;1-3-17(14-6-4-5-7-15(14)24)32-18-11-19(33-21(18)22(25)29)16-12-26-20-10-13(8-9-28(16)20)27-23(30)31-2;1-3-31-23(30)27-14-8-9-28-17(12-26-20(28)10-14)19-11-18(21(33-19)22(25)29)32-13(2)15-6-4-5-7-16(15)24;1-12(14-5-3-4-6-15(14)23)31-17-10-18(32-20(17)21(24)28)16-11-25-19-9-13(7-8-27(16)19)26-22(29)30-2/h5-14H,4H2,1-3H3,(H2,26,30);4-13H,1-3H3,(H2,25,29);4-12,17H,3H2,1-2H3,(H2,25,29)(H,27,30);4-13H,3H2,1-2H3,(H2,25,29)(H,27,30);3-12H,1-2H3,(H2,24,28)(H,26,29)/t;;17-;13-;12-/m..000/s1.

What are the key properties of ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate?

ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate has a molecular weight of 2424.82 g/mol, XLogP of 26.89, 33 rotatable bonds, 8 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for ethyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;ethyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate;methyl N-[3-[5-carbamoyl-4-[1-(2-chlorophenyl)ethoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]-N-methylcarbamate;methyl N-[3-[5-carbamoyl-4-[(1S)-1-(2-chlorophenyl)propoxy]thiophen-2-yl]imidazo[1,2-a]pyridin-7-yl]carbamate is sourced from PubChem (CID 157233684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).