ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate

C24H23NO5 — CID 135034452

IUPACethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate
SMILESCCOC(=O)C1[C@H]2CCC(=O)C12N1C(=O)O[C@H](c2ccccc2)[C@@H]1c1ccccc1
InChIInChI=1S/C24H23NO5/c1-2-29-22(27)19-17-13-14-18(26)24(17,19)25-20(15-9-5-3-6-10-15)21(30-23(25)28)16-11-7-4-8-12-16/h3-12,17,19-21H,2,13-14H2,1H3/t17-,19?,20+,21-,24?/m1/s1
InChIKeyAESUANKZEUWHJL-VQTBLBOUSA-N
MW405.45 g/mol
LogP3.83
Rot. Bonds5

About ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate

ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate (PubChem CID 135034452) has the molecular formula C24H23NO5 and a molecular weight of 405.45 g/mol. Its IUPAC name is ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate.

Molecular Properties

Compound Nameethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate
PubChem CID135034452
Molecular FormulaC24H23NO5
Molecular Weight405.45 g/mol
Exact Mass405.16
IUPAC Nameethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate
SMILESCCOC(=O)C1[C@H]2CCC(=O)C12N1C(=O)O[C@H](c2ccccc2)[C@@H]1c1ccccc1
InChIInChI=1S/C24H23NO5/c1-2-29-22(27)19-17-13-14-18(26)24(17,19)25-20(15-9-5-3-6-10-15)21(30-23(25)28)16-11-7-4-8-12-16/h3-12,17,19-21H,2,13-14H2,1H3/t17-,19?,20+,21-,24?/m1/s1
InChIKeyAESUANKZEUWHJL-VQTBLBOUSA-N
XLogP3.83
TPSA72.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.45
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate?
The IUPAC name of ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate (CID 135034452) is ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate.
What is the SMILES notation for ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate?
The canonical SMILES for ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate is CCOC(=O)C1[C@H]2CCC(=O)C12N1C(=O)O[C@H](c2ccccc2)[C@@H]1c1ccccc1.
What is the InChIKey of ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate?
The InChIKey is AESUANKZEUWHJL-VQTBLBOUSA-N. The full InChI is InChI=1S/C24H23NO5/c1-2-29-22(27)19-17-13-14-18(26)24(17,19)25-20(15-9-5-3-6-10-15)21(30-23(25)28)16-11-7-4-8-12-16/h3-12,17,19-21H,2,13-14H2,1H3/t17-,19?,20+,21-,24?/m1/s1.
What are the key properties of ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate?
ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate has a molecular weight of 405.45 g/mol, XLogP of 3.83, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (5R)-2-oxo-1-[(4S,5R)-2-oxo-4,5-diphenyl-1,3-oxazolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxylate is sourced from PubChem (CID 135034452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).