[(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate

C19H16ClNO5 — CID 10981614

IUPAC[(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate
SMILESCC(=O)[C@H](OC(=O)c1cccc(Cl)c1)N1C(=O)OC[C@H]1c1ccccc1
InChIInChI=1S/C19H16ClNO5/c1-12(22)17(26-18(23)14-8-5-9-15(20)10-14)21-16(11-25-19(21)24)13-6-3-2-4-7-13/h2-10,16-17H,11H2,1H3/t16-,17-/m0/s1
InChIKeyLHOKHDJOXYMOBJ-IRXDYDNUSA-N
MW373.79 g/mol
LogP3.61
Rot. Bonds5

About [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate

[(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate (PubChem CID 10981614) has the molecular formula C19H16ClNO5 and a molecular weight of 373.79 g/mol. Its IUPAC name is [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate.

Molecular Properties

Compound Name[(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate
PubChem CID10981614
Molecular FormulaC19H16ClNO5
Molecular Weight373.79 g/mol
Exact Mass373.07
IUPAC Name[(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate
SMILESCC(=O)[C@H](OC(=O)c1cccc(Cl)c1)N1C(=O)OC[C@H]1c1ccccc1
InChIInChI=1S/C19H16ClNO5/c1-12(22)17(26-18(23)14-8-5-9-15(20)10-14)21-16(11-25-19(21)24)13-6-3-2-4-7-13/h2-10,16-17H,11H2,1H3/t16-,17-/m0/s1
InChIKeyLHOKHDJOXYMOBJ-IRXDYDNUSA-N
XLogP3.61
TPSA72.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.79
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate with MolForge

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Related Compounds

2-(4-methylphenyl)-2-oxo-1-phenylethyl N-(4-chlorobenzoyl)glycinate
CID 2926382
2-(4-chlorophenyl)-2-oxo-1-phenylethyl (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
CID 2935050
2-Benzyloxy-2-(3-chloro-benzoylamino)-3,3,3-trifluoro-propionic acid ethyl ester
CID 2802434
[(2R,3R)-4-oxo-2-phenyl-1-[(E)-3-phenylprop-2-enoyl]-2,3-dihydropyridin-3-yl] 4-chlorobenzoate
CID 72710910
[2-(Benzylamino)-2-oxoethyl] 3-chlorobenzoate
CID 1648591
methyl (E)-2-[[(2R,3S)-2-(3-chlorophenyl)-3-methoxy-4-oxoazetidin-1-yl]methyl]-3-phenylprop-2-enoate
CID 134148198
(3-Chlorophenyl)(2-phenylmorpholino)methanone
CID 16894702
(2R,4S)-3-Benzoyl-4-methyl-2-phenyl-5-oxazolidinone
CID 11065866
(2S,4R)-3-Benzoyl-4-methyl-2-phenyl-1,3-oxazolidin-5-one
CID 13818180
(2R,4R)-3-benzoyl-4-methyl-2-phenyl-1,3-oxazolidin-5-one
CID 29972656
[2-[Benzyl(propan-2-yl)amino]-2-oxoethyl] 2-chloro-4-fluorobenzoate
CID 2364527
2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)ethyl 3-chlorobenzoate
CID 2504001

Frequently Asked Questions

What is the IUPAC name of [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate?
The IUPAC name of [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate (CID 10981614) is [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate.
What is the SMILES notation for [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate?
The canonical SMILES for [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate is CC(=O)[C@H](OC(=O)c1cccc(Cl)c1)N1C(=O)OC[C@H]1c1ccccc1.
What is the InChIKey of [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate?
The InChIKey is LHOKHDJOXYMOBJ-IRXDYDNUSA-N. The full InChI is InChI=1S/C19H16ClNO5/c1-12(22)17(26-18(23)14-8-5-9-15(20)10-14)21-16(11-25-19(21)24)13-6-3-2-4-7-13/h2-10,16-17H,11H2,1H3/t16-,17-/m0/s1.
What are the key properties of [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate?
[(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate has a molecular weight of 373.79 g/mol, XLogP of 3.61, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S)-2-oxo-1-[(4R)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]propyl] 3-chlorobenzoate is sourced from PubChem (CID 10981614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).