(4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one

C18H14Cl2N2O4 — CID 11429301

IUPAC(4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one
SMILESO=C1OC[C@H]([C@H]2COC(=O)N2c2ccc(Cl)cc2)N1c1ccc(Cl)cc1
InChIInChI=1S/C18H14Cl2N2O4/c19-11-1-5-13(6-2-11)21-15(9-25-17(21)23)16-10-26-18(24)22(16)14-7-3-12(20)4-8-14/h1-8,15-16H,9-10H2/t15-,16-/m1/s1
InChIKeyHKXUICPDZBMWEU-HZPDHXFCSA-N
MW393.23 g/mol
LogP4.34
Rot. Bonds3

About (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one

(4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one (PubChem CID 11429301) has the molecular formula C18H14Cl2N2O4 and a molecular weight of 393.23 g/mol. Its IUPAC name is (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one
PubChem CID11429301
Molecular FormulaC18H14Cl2N2O4
Molecular Weight393.23 g/mol
Exact Mass392.03
IUPAC Name(4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one
SMILESO=C1OC[C@H]([C@H]2COC(=O)N2c2ccc(Cl)cc2)N1c1ccc(Cl)cc1
InChIInChI=1S/C18H14Cl2N2O4/c19-11-1-5-13(6-2-11)21-15(9-25-17(21)23)16-10-26-18(24)22(16)14-7-3-12(20)4-8-14/h1-8,15-16H,9-10H2/t15-,16-/m1/s1
InChIKeyHKXUICPDZBMWEU-HZPDHXFCSA-N
XLogP4.34
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.23
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one with MolForge

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Related Compounds

3-(4-chlorophenyl)-4-methyl-1,3-oxazolidin-2-one
CID 14268537
(4R)-3-(4-chlorophenyl)-4-ethenyl-1,3-oxazolidin-2-one
CID 134918442
3-(3-chlorophenyl)-4-piperidin-4-yl-1,3-oxazolidin-2-one
CID 115064126
(4S)-3-(4-chlorophenyl)-4-(3-phenoxyphenyl)-1,3-oxazolidin-2-one
CID 59485641
3-(3-chloro-4-fluorophenyl)-4-ethenyl-1,3-oxazolidin-2-one
CID 10586207
3-(4-fluorophenyl)-4-pyrrolidin-3-yl-1,3-oxazolidin-2-one
CID 115064330
methyl 3-(4-chlorophenyl)-2-oxo-1,3-oxazinane-4-carboxylate
CID 24976381
methyl 4-[[3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]methoxy]benzoate
CID 18997214
3-(4-chlorophenyl)-3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-one
CID 141369304
4-pyrrolidin-3-yl-3-[4-(trifluoromethyl)phenyl]-1,3-oxazolidin-2-one
CID 115064326
3-(3H-benzimidazol-5-yl)-4-(4-chlorophenyl)-1,3-oxazolidin-2-one
CID 67036274
4-nitro-3-phenyl-1,3-oxazolidin-2-one
CID 54515958

Frequently Asked Questions

What is the IUPAC name of (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one?
The IUPAC name of (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one (CID 11429301) is (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one.
What is the SMILES notation for (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one?
The canonical SMILES for (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one is O=C1OC[C@H]([C@H]2COC(=O)N2c2ccc(Cl)cc2)N1c1ccc(Cl)cc1.
What is the InChIKey of (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one?
The InChIKey is HKXUICPDZBMWEU-HZPDHXFCSA-N. The full InChI is InChI=1S/C18H14Cl2N2O4/c19-11-1-5-13(6-2-11)21-15(9-25-17(21)23)16-10-26-18(24)22(16)14-7-3-12(20)4-8-14/h1-8,15-16H,9-10H2/t15-,16-/m1/s1.
What are the key properties of (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one?
(4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one has a molecular weight of 393.23 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-3-(4-chlorophenyl)-4-[(4S)-3-(4-chlorophenyl)-2-oxo-1,3-oxazolidin-4-yl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 11429301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).