N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide

C141H88Cl8F7N15O14S — CID 157487009

IUPACN-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide
SMILESCc1nc2cc(Cl)c(-c3ccc(NC(=O)c4c(F)cccc4F)cc3)cc2o1.Cc1nc2cc(Cl)c(-c3ccc(NC(=O)c4ccccc4Cl)cc3)cc2o1.Cc1nc2cc(Cl)c(-c3ccc(NC(=O)c4ccccc4F)cc3)cc2o1.Cc1ncsc1C(=O)Nc1ccc(-c2cc3ocnc3cc2Cl)cc1.O=C(Nc1ccc(-c2cc3ocnc3cc2Cl)cc1)c1c(F)cccc1F.O=C(Nc1ccc(-c2cc3ocnc3cc2Cl)cc1)c1ccccc1F.O=C(Nc1ccc(-c2cc3ocnc3cc2Cl)cc1)c1ccccc1F
InChIInChI=1S/C21H14Cl2N2O2.C21H13ClF2N2O2.C21H14ClFN2O2.C20H11ClF2N2O2.2C20H12ClFN2O2.C18H12ClN3O2S/c1-12-24-19-11-18(23)16(10-20(19)27-12)13-6-8-14(9-7-13)25-21(26)15-4-2-3-5-17(15)22;1-11-25-18-10-15(22)14(9-19(18)28-11)12-5-7-13(8-6-12)26-21(27)20-16(23)3-2-4-17(20)24;1-12-24-19-11-17(22)16(10-20(19)27-12)13-6-8-14(9-7-13)25-21(26)15-4-2-3-5-18(15)23;21-14-9-17-18(27-10-24-17)8-13(14)11-4-6-12(7-5-11)25-20(26)19-15(22)2-1-3-16(19)23;2*21-16-10-18-19(26-11-23-18)9-15(16)12-5-7-13(8-6-12)24-20(25)14-3-1-2-4-17(14)22;1-10-17(25-9-21-10)18(23)22-12-4-2-11(3-5-12)13-6-16-15(7-14(13)19)20-8-24-16/h2-11H,1H3,(H,25,26);2-10H,1H3,(H,26,27);2-11H,1H3,(H,25,26);1-10H,(H,25,26);2*1-11H,(H,24,25);2-9H,1H3,(H,22,23)
InChIKeyBWVLDJBPISIGTO-UHFFFAOYSA-N
MW2665.02 g/mol
LogP40.12
Rot. Bonds21

About N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide

N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide (PubChem CID 157487009) has the molecular formula C141H88Cl8F7N15O14S and a molecular weight of 2665.02 g/mol. Its IUPAC name is N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide.

Molecular Properties

Compound NameN-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide
PubChem CID157487009
Molecular FormulaC141H88Cl8F7N15O14S
Molecular Weight2665.02 g/mol
Exact Mass2659.38
IUPAC NameN-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide
SMILESCc1nc2cc(Cl)c(-c3ccc(NC(=O)c4c(F)cccc4F)cc3)cc2o1.Cc1nc2cc(Cl)c(-c3ccc(NC(=O)c4ccccc4Cl)cc3)cc2o1.Cc1nc2cc(Cl)c(-c3ccc(NC(=O)c4ccccc4F)cc3)cc2o1.Cc1ncsc1C(=O)Nc1ccc(-c2cc3ocnc3cc2Cl)cc1.O=C(Nc1ccc(-c2cc3ocnc3cc2Cl)cc1)c1c(F)cccc1F.O=C(Nc1ccc(-c2cc3ocnc3cc2Cl)cc1)c1ccccc1F.O=C(Nc1ccc(-c2cc3ocnc3cc2Cl)cc1)c1ccccc1F
InChIInChI=1S/C21H14Cl2N2O2.C21H13ClF2N2O2.C21H14ClFN2O2.C20H11ClF2N2O2.2C20H12ClFN2O2.C18H12ClN3O2S/c1-12-24-19-11-18(23)16(10-20(19)27-12)13-6-8-14(9-7-13)25-21(26)15-4-2-3-5-17(15)22;1-11-25-18-10-15(22)14(9-19(18)28-11)12-5-7-13(8-6-12)26-21(27)20-16(23)3-2-4-17(20)24;1-12-24-19-11-17(22)16(10-20(19)27-12)13-6-8-14(9-7-13)25-21(26)15-4-2-3-5-18(15)23;21-14-9-17-18(27-10-24-17)8-13(14)11-4-6-12(7-5-11)25-20(26)19-15(22)2-1-3-16(19)23;2*21-16-10-18-19(26-11-23-18)9-15(16)12-5-7-13(8-6-12)24-20(25)14-3-1-2-4-17(14)22;1-10-17(25-9-21-10)18(23)22-12-4-2-11(3-5-12)13-6-16-15(7-14(13)19)20-8-24-16/h2-11H,1H3,(H,25,26);2-10H,1H3,(H,26,27);2-11H,1H3,(H,25,26);1-10H,(H,25,26);2*1-11H,(H,24,25);2-9H,1H3,(H,22,23)
InChIKeyBWVLDJBPISIGTO-UHFFFAOYSA-N
XLogP40.12
TPSA398.80 Ų
H-Bond Donors7
H-Bond Acceptors23
Rotatable Bonds21
Heavy Atoms186
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002665.02
LogP ≤ 540.12
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1023

Analyze N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide?
The IUPAC name of N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide (CID 157487009) is N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide.
What is the SMILES notation for N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide?
The canonical SMILES for N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide is Cc1nc2cc(Cl)c(-c3ccc(NC(=O)c4c(F)cccc4F)cc3)cc2o1.Cc1nc2cc(Cl)c(-c3ccc(NC(=O)c4ccccc4Cl)cc3)cc2o1.Cc1nc2cc(Cl)c(-c3ccc(NC(=O)c4ccccc4F)cc3)cc2o1.Cc1ncsc1C(=O)Nc1ccc(-c2cc3ocnc3cc2Cl)cc1.O=C(Nc1ccc(-c2cc3ocnc3cc2Cl)cc1)c1c(F)cccc1F.O=C(Nc1ccc(-c2cc3ocnc3cc2Cl)cc1)c1ccccc1F.O=C(Nc1ccc(-c2cc3ocnc3cc2Cl)cc1)c1ccccc1F.
What is the InChIKey of N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide?
The InChIKey is BWVLDJBPISIGTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14Cl2N2O2.C21H13ClF2N2O2.C21H14ClFN2O2.C20H11ClF2N2O2.2C20H12ClFN2O2.C18H12ClN3O2S/c1-12-24-19-11-18(23)16(10-20(19)27-12)13-6-8-14(9-7-13)25-21(26)15-4-2-3-5-17(15)22;1-11-25-18-10-15(22)14(9-19(18)28-11)12-5-7-13(8-6-12)26-21(27)20-16(23)3-2-4-17(20)24;1-12-24-19-11-17(22)16(10-20(19)27-12)13-6-8-14(9-7-13)25-21(26)15-4-2-3-5-18(15)23;21-14-9-17-18(27-10-24-17)8-13(14)11-4-6-12(7-5-11)25-20(26)19-15(22)2-1-3-16(19)23;2*21-16-10-18-19(26-11-23-18)9-15(16)12-5-7-13(8-6-12)24-20(25)14-3-1-2-4-17(14)22;1-10-17(25-9-21-10)18(23)22-12-4-2-11(3-5-12)13-6-16-15(7-14(13)19)20-8-24-16/h2-11H,1H3,(H,25,26);2-10H,1H3,(H,26,27);2-11H,1H3,(H,25,26);1-10H,(H,25,26);2*1-11H,(H,24,25);2-9H,1H3,(H,22,23).
What are the key properties of N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide?
N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide has a molecular weight of 2665.02 g/mol, XLogP of 40.12, 21 rotatable bonds, 7 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;bis(N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide);N-[4-(5-chloro-1,3-benzoxazol-6-yl)phenyl]-4-methyl-1,3-thiazole-5-carboxamide;2-chloro-N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]benzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2,6-difluorobenzamide;N-[4-(5-chloro-2-methyl-1,3-benzoxazol-6-yl)phenyl]-2-fluorobenzamide is sourced from PubChem (CID 157487009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).