(2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide

C16H13Cl2FN2OS — CID 7288804

IUPAC(2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)N1CCS[C@H]1c1ccccc1F
InChIInChI=1S/C16H13Cl2FN2OS/c17-11-5-3-7-13(14(11)18)20-16(22)21-8-9-23-15(21)10-4-1-2-6-12(10)19/h1-7,15H,8-9H2,(H,20,22)/t15-/m0/s1
InChIKeyUQPQGBFXYRAUSL-HNNXBMFYSA-N
MW371.26 g/mol
LogP5.41
Rot. Bonds2

About (2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide

(2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide (PubChem CID 7288804) has the molecular formula C16H13Cl2FN2OS and a molecular weight of 371.26 g/mol. Its IUPAC name is (2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
PubChem CID7288804
Molecular FormulaC16H13Cl2FN2OS
Molecular Weight371.26 g/mol
Exact Mass370.01
IUPAC Name(2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)N1CCS[C@H]1c1ccccc1F
InChIInChI=1S/C16H13Cl2FN2OS/c17-11-5-3-7-13(14(11)18)20-16(22)21-8-9-23-15(21)10-4-1-2-6-12(10)19/h1-7,15H,8-9H2,(H,20,22)/t15-/m0/s1
InChIKeyUQPQGBFXYRAUSL-HNNXBMFYSA-N
XLogP5.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.26
LogP ≤ 55.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7297065
(2S)-2-(2,3-dichlorophenyl)-N-(2-methylphenyl)-1,3-thiazolidine-3-carboxamide
CID 7495293
(2R)-2-(2-fluorophenyl)-N-[2-(trifluoromethyl)phenyl]-1,3-thiazolidine-3-carboxamide
CID 7440090
2-(2,3-dichlorophenyl)-N-(2-ethylphenyl)-1,3-thiazolidine-3-carboxamide
CID 5211788
N-(2,3-dichlorophenyl)-2-(2,3-dimethoxyphenyl)-1,3-thiazolidine-3-carboxamide
CID 4200428
(2S)-N-(3-chloro-4-methylphenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7301691
N-(2,3-dichlorophenyl)-2-(1-methylpyrrol-2-yl)-1,3-thiazolidine-3-carboxamide
CID 42781193
(2S)-N-(2,3-dichlorophenyl)-2-(2,5-dimethoxyphenyl)-1,3-thiazolidine-3-carboxamide
CID 7328188
(2R)-2-(2-fluorophenyl)-N-(4-methylphenyl)-1,3-thiazolidine-3-carboxamide
CID 7499220
(2R)-2-(2,3-dichlorophenyl)-N-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-3-carboxamide
CID 97496235
2-(2,4-dichlorophenyl)-N-naphthalen-1-yl-1,3-thiazolidine-3-carboxamide
CID 4691559
(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-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide?
The IUPAC name of (2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide (CID 7288804) is (2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide.
What is the SMILES notation for (2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide?
The canonical SMILES for (2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide is O=C(Nc1cccc(Cl)c1Cl)N1CCS[C@H]1c1ccccc1F.
What is the InChIKey of (2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide?
The InChIKey is UQPQGBFXYRAUSL-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H13Cl2FN2OS/c17-11-5-3-7-13(14(11)18)20-16(22)21-8-9-23-15(21)10-4-1-2-6-12(10)19/h1-7,15H,8-9H2,(H,20,22)/t15-/m0/s1.
What are the key properties of (2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide?
(2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide has a molecular weight of 371.26 g/mol, XLogP of 5.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide is sourced from PubChem (CID 7288804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).