N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide

C142H134F8N26O25S3 — CID 159450640

IUPACN-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide
SMILESCC[C@H]1CN(c2ccc(C(=O)Nc3cc(C)ns3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3ccc(OC)nc3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3ccccn3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3cccnc3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3ccncc3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3cnc4ccccc4c3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3nc(N)c(-c4ccccc4)s3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3nnc(C)s3)c(F)c2)C(=O)O1
InChIInChI=1S/C21H19FN4O3S.C21H18FN3O3.C18H18FN3O4.3C17H16FN3O3.C16H16FN3O3S.C15H15FN4O3S/c1-2-14-11-26(21(28)29-14)13-8-9-15(16(22)10-13)19(27)25-20-24-18(23)17(30-20)12-6-4-3-5-7-12;1-2-16-12-25(21(27)28-16)15-7-8-17(18(22)10-15)20(26)24-14-9-13-5-3-4-6-19(13)23-11-14;1-3-13-10-22(18(24)26-13)12-5-6-14(15(19)8-12)17(23)21-11-4-7-16(25-2)20-9-11;1-2-13-10-21(17(23)24-13)12-3-4-14(15(18)9-12)16(22)20-11-5-7-19-8-6-11;1-2-13-10-21(17(23)24-13)12-5-6-14(15(18)8-12)16(22)20-11-4-3-7-19-9-11;1-2-12-10-21(17(23)24-12)11-6-7-13(14(18)9-11)16(22)20-15-5-3-4-8-19-15;1-3-11-8-20(16(22)23-11)10-4-5-12(13(17)7-10)15(21)18-14-6-9(2)19-24-14;1-3-10-7-20(15(22)23-10)9-4-5-11(12(16)6-9)13(21)17-14-19-18-8(2)24-14/h3-10,14H,2,11,23H2,1H3,(H,24,25,27);3-11,16H,2,12H2,1H3,(H,24,26);4-9,13H,3,10H2,1-2H3,(H,21,23);3-9,13H,2,10H2,1H3,(H,19,20,22);3-9,13H,2,10H2,1H3,(H,20,22);3-9,12H,2,10H2,1H3,(H,19,20,22);4-7,11H,3,8H2,1-2H3,(H,18,21);4-6,10H,3,7H2,1-2H3,(H,17,19,21)/t14-;16-;3*13-;12-;11-;10-/m00000000/s1
InChIKeyLTIDJUKCBCTZLB-NMJRSHKNSA-N
MW2852.98 g/mol
LogP28.27
Rot. Bonds34

About N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide

N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide (PubChem CID 159450640) has the molecular formula C142H134F8N26O25S3 and a molecular weight of 2852.98 g/mol. Its IUPAC name is N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide.

Molecular Properties

Compound NameN-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide
PubChem CID159450640
Molecular FormulaC142H134F8N26O25S3
Molecular Weight2852.98 g/mol
Exact Mass2850.90
IUPAC NameN-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide
SMILESCC[C@H]1CN(c2ccc(C(=O)Nc3cc(C)ns3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3ccc(OC)nc3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3ccccn3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3cccnc3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3ccncc3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3cnc4ccccc4c3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3nc(N)c(-c4ccccc4)s3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3nnc(C)s3)c(F)c2)C(=O)O1
InChIInChI=1S/C21H19FN4O3S.C21H18FN3O3.C18H18FN3O4.3C17H16FN3O3.C16H16FN3O3S.C15H15FN4O3S/c1-2-14-11-26(21(28)29-14)13-8-9-15(16(22)10-13)19(27)25-20-24-18(23)17(30-20)12-6-4-3-5-7-12;1-2-16-12-25(21(27)28-16)15-7-8-17(18(22)10-15)20(26)24-14-9-13-5-3-4-6-19(13)23-11-14;1-3-13-10-22(18(24)26-13)12-5-6-14(15(19)8-12)17(23)21-11-4-7-16(25-2)20-9-11;1-2-13-10-21(17(23)24-13)12-3-4-14(15(18)9-12)16(22)20-11-5-7-19-8-6-11;1-2-13-10-21(17(23)24-13)12-5-6-14(15(18)8-12)16(22)20-11-4-3-7-19-9-11;1-2-12-10-21(17(23)24-12)11-6-7-13(14(18)9-11)16(22)20-15-5-3-4-8-19-15;1-3-11-8-20(16(22)23-11)10-4-5-12(13(17)7-10)15(21)18-14-6-9(2)19-24-14;1-3-10-7-20(15(22)23-10)9-4-5-11(12(16)6-9)13(21)17-14-19-18-8(2)24-14/h3-10,14H,2,11,23H2,1H3,(H,24,25,27);3-11,16H,2,12H2,1H3,(H,24,26);4-9,13H,3,10H2,1-2H3,(H,21,23);3-9,13H,2,10H2,1H3,(H,19,20,22);3-9,13H,2,10H2,1H3,(H,20,22);3-9,12H,2,10H2,1H3,(H,19,20,22);4-7,11H,3,8H2,1-2H3,(H,18,21);4-6,10H,3,7H2,1-2H3,(H,17,19,21)/t14-;16-;3*13-;12-;11-;10-/m00000000/s1
InChIKeyLTIDJUKCBCTZLB-NMJRSHKNSA-N
XLogP28.27
TPSA620.38 Ų
H-Bond Donors9
H-Bond Acceptors38
Rotatable Bonds34
Heavy Atoms204
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002852.98
LogP ≤ 528.27
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

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

Analyze N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide?
The IUPAC name of N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide (CID 159450640) is N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide.
What is the SMILES notation for N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide?
The canonical SMILES for N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide is CC[C@H]1CN(c2ccc(C(=O)Nc3cc(C)ns3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3ccc(OC)nc3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3ccccn3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3cccnc3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3ccncc3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3cnc4ccccc4c3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3nc(N)c(-c4ccccc4)s3)c(F)c2)C(=O)O1.CC[C@H]1CN(c2ccc(C(=O)Nc3nnc(C)s3)c(F)c2)C(=O)O1.
What is the InChIKey of N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide?
The InChIKey is LTIDJUKCBCTZLB-NMJRSHKNSA-N. The full InChI is InChI=1S/C21H19FN4O3S.C21H18FN3O3.C18H18FN3O4.3C17H16FN3O3.C16H16FN3O3S.C15H15FN4O3S/c1-2-14-11-26(21(28)29-14)13-8-9-15(16(22)10-13)19(27)25-20-24-18(23)17(30-20)12-6-4-3-5-7-12;1-2-16-12-25(21(27)28-16)15-7-8-17(18(22)10-15)20(26)24-14-9-13-5-3-4-6-19(13)23-11-14;1-3-13-10-22(18(24)26-13)12-5-6-14(15(19)8-12)17(23)21-11-4-7-16(25-2)20-9-11;1-2-13-10-21(17(23)24-13)12-3-4-14(15(18)9-12)16(22)20-11-5-7-19-8-6-11;1-2-13-10-21(17(23)24-13)12-5-6-14(15(18)8-12)16(22)20-11-4-3-7-19-9-11;1-2-12-10-21(17(23)24-12)11-6-7-13(14(18)9-11)16(22)20-15-5-3-4-8-19-15;1-3-11-8-20(16(22)23-11)10-4-5-12(13(17)7-10)15(21)18-14-6-9(2)19-24-14;1-3-10-7-20(15(22)23-10)9-4-5-11(12(16)6-9)13(21)17-14-19-18-8(2)24-14/h3-10,14H,2,11,23H2,1H3,(H,24,25,27);3-11,16H,2,12H2,1H3,(H,24,26);4-9,13H,3,10H2,1-2H3,(H,21,23);3-9,13H,2,10H2,1H3,(H,19,20,22);3-9,13H,2,10H2,1H3,(H,20,22);3-9,12H,2,10H2,1H3,(H,19,20,22);4-7,11H,3,8H2,1-2H3,(H,18,21);4-6,10H,3,7H2,1-2H3,(H,17,19,21)/t14-;16-;3*13-;12-;11-;10-/m00000000/s1.
What are the key properties of N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide?
N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide has a molecular weight of 2852.98 g/mol, XLogP of 28.27, 34 rotatable bonds, 9 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-5-phenyl-1,3-thiazol-2-yl)-4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluorobenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(6-methoxy-3-pyridinyl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-(3-methyl-1,2-thiazol-5-yl)benzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-2-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-3-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-pyridin-4-ylbenzamide;4-[(5S)-5-ethyl-2-oxo-1,3-oxazolidin-3-yl]-2-fluoro-N-quinolin-3-ylbenzamide is sourced from PubChem (CID 159450640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).