4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate

C122H98Cl8N8O20 — CID 159631222

About 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate

4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate (PubChem CID 159631222) has the molecular formula C122H98Cl8N8O20 and a molecular weight of 2279.79 g/mol. Its IUPAC name is 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate.

Molecular Properties

• Compound Name: 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate
• PubChem CID: 159631222
• Molecular Formula: C122H98Cl8N8O20
• Molecular Weight: 2279.79 g/mol
• Exact Mass: 2274.44
• IUPAC Name: 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate
• SMILES: CC1(C)C(=O)N(Cc2ccc(C(=O)O)cc2)c2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C3CC3)cc21.CC1(C)C(=O)N(Cc2cccc(OC=O)c2)c2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C3CC3)cc21.CC1(C)C(=O)N(c2cccc(OC=O)c2)c2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C3CC3)cc21.O=COc1cccc(N2C(=O)C3(CC3)c3cc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)ccc32)c1
• InChI: InChI=1S/2C31H26Cl2N2O5.C30H22Cl2N2O5.C30H24Cl2N2O5/c1-31(2)23-14-21(11-12-26(23)35(30(31)37)15-18-5-3-6-20(13-18)39-17-36)38-16-22-28(34-40-29(22)19-9-10-19)27-24(32)7-4-8-25(27)33;1-31(2)22-14-20(12-13-25(22)35(30(31)38)15-17-6-8-19(9-7-17)29(36)37)39-16-21-27(34-40-28(21)18-10-11-18)26-23(32)4-3-5-24(26)33;31-23-5-2-6-24(32)26(23)27-21(28(39-33-27)17-7-8-17)15-37-20-9-10-25-22(14-20)30(11-12-30)29(36)34(25)18-3-1-4-19(13-18)38-16-35;1-30(2)22-14-20(11-12-25(22)34(29(30)36)18-5-3-6-19(13-18)38-16-35)37-15-21-27(33-39-28(21)17-9-10-17)26-23(31)7-4-8-24(26)32/h3-8,11-14,17,19H,9-10,15-16H2,1-2H3;3-9,12-14,18H,10-11,15-16H2,1-2H3,(H,36,37);1-6,9-10,13-14,16-17H,7-8,11-12,15H2;3-8,11-14,16-17H,9-10,15H2,1-2H3
• InChIKey: MPDPFDMZWMFUIC-UHFFFAOYSA-N
• XLogP: 30.04
• TPSA: 338.48 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 23
• Rotatable Bonds: 33
• Heavy Atoms: 158
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2279.79
LogP ≤ 5	30.04
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate?

The IUPAC name of 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate (CID 159631222) is 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate.

What is the SMILES notation for 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate?

The canonical SMILES for 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate is CC1(C)C(=O)N(Cc2ccc(C(=O)O)cc2)c2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C3CC3)cc21.CC1(C)C(=O)N(Cc2cccc(OC=O)c2)c2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C3CC3)cc21.CC1(C)C(=O)N(c2cccc(OC=O)c2)c2ccc(OCc3c(-c4c(Cl)cccc4Cl)noc3C3CC3)cc21.O=COc1cccc(N2C(=O)C3(CC3)c3cc(OCc4c(-c5c(Cl)cccc5Cl)noc4C4CC4)ccc32)c1.

What is the InChIKey of 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate?

The InChIKey is MPDPFDMZWMFUIC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C31H26Cl2N2O5.C30H22Cl2N2O5.C30H24Cl2N2O5/c1-31(2)23-14-21(11-12-26(23)35(30(31)37)15-18-5-3-6-20(13-18)39-17-36)38-16-22-28(34-40-29(22)19-9-10-19)27-24(32)7-4-8-25(27)33;1-31(2)22-14-20(12-13-25(22)35(30(31)38)15-17-6-8-19(9-7-17)29(36)37)39-16-21-27(34-40-28(21)18-10-11-18)26-23(32)4-3-5-24(26)33;31-23-5-2-6-24(32)26(23)27-21(28(39-33-27)17-7-8-17)15-37-20-9-10-25-22(14-20)30(11-12-30)29(36)34(25)18-3-1-4-19(13-18)38-16-35;1-30(2)22-14-20(11-12-25(22)34(29(30)36)18-5-3-6-19(13-18)38-16-35)37-15-21-27(33-39-28(21)17-9-10-17)26-23(31)7-4-8-24(26)32/h3-8,11-14,17,19H,9-10,15-16H2,1-2H3;3-9,12-14,18H,10-11,15-16H2,1-2H3,(H,36,37);1-6,9-10,13-14,16-17H,7-8,11-12,15H2;3-8,11-14,16-17H,9-10,15H2,1-2H3.

What are the key properties of 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate?

4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate has a molecular weight of 2279.79 g/mol, XLogP of 30.04, 33 rotatable bonds, 1 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]benzoic acid;[3-[[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]methyl]phenyl] formate;[3-[5-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-3,3-dimethyl-2-oxoindol-1-yl]phenyl] formate;[3-[5'-[[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy]-2'-oxospiro[cyclopropane-1,3'-indole]-1'-yl]phenyl] formate is sourced from PubChem (CID 159631222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).