(2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide

C15H14Cl2N2O2S — CID 7362222

IUPAC(2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide
SMILESCc1ccc([C@@H]2SCCN2C(=O)Nc2c(Cl)cccc2Cl)o1
InChIInChI=1S/C15H14Cl2N2O2S/c1-9-5-6-12(21-9)14-19(7-8-22-14)15(20)18-13-10(16)3-2-4-11(13)17/h2-6,14H,7-8H2,1H3,(H,18,20)/t14-/m0/s1
InChIKeySMRIJILAQKXRIO-AWEZNQCLSA-N
MW357.26 g/mol
LogP5.17
Rot. Bonds2

About (2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide

(2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide (PubChem CID 7362222) has the molecular formula C15H14Cl2N2O2S and a molecular weight of 357.26 g/mol. Its IUPAC name is (2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide
PubChem CID7362222
Molecular FormulaC15H14Cl2N2O2S
Molecular Weight357.26 g/mol
Exact Mass356.02
IUPAC Name(2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide
SMILESCc1ccc([C@@H]2SCCN2C(=O)Nc2c(Cl)cccc2Cl)o1
InChIInChI=1S/C15H14Cl2N2O2S/c1-9-5-6-12(21-9)14-19(7-8-22-14)15(20)18-13-10(16)3-2-4-11(13)17/h2-6,14H,7-8H2,1H3,(H,18,20)/t14-/m0/s1
InChIKeySMRIJILAQKXRIO-AWEZNQCLSA-N
XLogP5.17
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.26
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide
CID 46125574
(2R)-2-(3-chlorophenyl)-N-(2,6-dichlorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7226698
(2R)-N-(2,6-dichlorophenyl)-2-(4-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7283743
(2R)-N-(2,6-dichlorophenyl)-2-(3,5-dimethoxyphenyl)-1,3-thiazolidine-3-carboxamide
CID 1025688
1-[2-(5-methylfuran-2-yl)-1,3-thiazolidin-3-yl]ethanone
CID 42781148
[2-(5-methylfuran-2-yl)-1,3-thiazolidin-3-yl]-(2-methylphenyl)methanone
CID 42781149
(2R)-N-(2,6-dichlorophenyl)-2-(2,5-dimethoxyphenyl)-1,3-thiazolidine-3-carboxamide
CID 7415606
N-(2,6-dichlorophenyl)-2-(2,3-dimethoxyphenyl)-1,3-thiazolidine-3-carboxamide
CID 5240782
[2-(5-methylfuran-2-yl)-1,3-thiazolidin-3-yl]-(4-phenylphenyl)methanone
CID 42665419
(2S)-2-(2,3-dichlorophenyl)-N-(2-methylphenyl)-1,3-thiazolidine-3-carboxamide
CID 7495293
N-[2,6-di(propan-2-yl)phenyl]-2-(4-propan-2-ylphenyl)-1,3-thiazolidine-3-carboxamide
CID 5077872
(2R)-2-(2,3-dichlorophenyl)-N-(4-propan-2-ylphenyl)-1,3-thiazolidine-3-carboxamide
CID 7416385

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide?
The IUPAC name of (2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide (CID 7362222) is (2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide.
What is the SMILES notation for (2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide?
The canonical SMILES for (2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide is Cc1ccc([C@@H]2SCCN2C(=O)Nc2c(Cl)cccc2Cl)o1.
What is the InChIKey of (2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide?
The InChIKey is SMRIJILAQKXRIO-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H14Cl2N2O2S/c1-9-5-6-12(21-9)14-19(7-8-22-14)15(20)18-13-10(16)3-2-4-11(13)17/h2-6,14H,7-8H2,1H3,(H,18,20)/t14-/m0/s1.
What are the key properties of (2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide?
(2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide has a molecular weight of 357.26 g/mol, XLogP of 5.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2,6-dichlorophenyl)-2-(5-methylfuran-2-yl)-1,3-thiazolidine-3-carboxamide is sourced from PubChem (CID 7362222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).