(2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide

C16H14BrFN2OS — CID 7297065

IUPAC(2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
SMILESO=C(Nc1ccccc1Br)N1CCS[C@@H]1c1ccccc1F
InChIInChI=1S/C16H14BrFN2OS/c17-12-6-2-4-8-14(12)19-16(21)20-9-10-22-15(20)11-5-1-3-7-13(11)18/h1-8,15H,9-10H2,(H,19,21)/t15-/m1/s1
InChIKeyHXKPAXVGYOUNBW-OAHLLOKOSA-N
MW381.27 g/mol
LogP4.87
Rot. Bonds2

About (2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide

(2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide (PubChem CID 7297065) has the molecular formula C16H14BrFN2OS and a molecular weight of 381.27 g/mol. Its IUPAC name is (2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide.

Molecular Properties

Compound Name(2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
PubChem CID7297065
Molecular FormulaC16H14BrFN2OS
Molecular Weight381.27 g/mol
Exact Mass380.00
IUPAC Name(2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
SMILESO=C(Nc1ccccc1Br)N1CCS[C@@H]1c1ccccc1F
InChIInChI=1S/C16H14BrFN2OS/c17-12-6-2-4-8-14(12)19-16(21)20-9-10-22-15(20)11-5-1-3-7-13(11)18/h1-8,15H,9-10H2,(H,19,21)/t15-/m1/s1
InChIKeyHXKPAXVGYOUNBW-OAHLLOKOSA-N
XLogP4.87
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.27
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(2-fluorophenyl)-N-[2-(trifluoromethyl)phenyl]-1,3-thiazolidine-3-carboxamide
CID 7440090
(2S)-N-(2,3-dichlorophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7288804
(2R)-2-(2-fluorophenyl)-N-(4-methylphenyl)-1,3-thiazolidine-3-carboxamide
CID 7499220
(2R)-N-(2-bromophenyl)-2-(4-propan-2-ylphenyl)-1,3-thiazolidine-3-carboxamide
CID 1025816
(2R)-N-(2-bromophenyl)-2-(3-chlorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7418004
(2S)-N-(3,5-dimethoxyphenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7349968
(2S)-N-(3-chloro-4-methylphenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 7301691
N-(1,3-benzodioxol-5-yl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 86264755
(2R)-N-(2-fluorophenyl)-2-(furan-2-yl)-1,3-thiazolidine-3-carboxamide
CID 7499158
(2R)-N-(2-fluorophenyl)-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidine-3-carboxamide
CID 7238468
(2R)-2-(3-bromo-4-fluorophenyl)-N-(2-methoxyphenyl)-1,3-thiazolidine-3-carboxamide
CID 99986077
2-(3,5-dimethoxyphenyl)-N-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide
CID 42781204

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide?
The IUPAC name of (2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide (CID 7297065) is (2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide.
What is the SMILES notation for (2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide?
The canonical SMILES for (2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide is O=C(Nc1ccccc1Br)N1CCS[C@@H]1c1ccccc1F.
What is the InChIKey of (2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide?
The InChIKey is HXKPAXVGYOUNBW-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H14BrFN2OS/c17-12-6-2-4-8-14(12)19-16(21)20-9-10-22-15(20)11-5-1-3-7-13(11)18/h1-8,15H,9-10H2,(H,19,21)/t15-/m1/s1.
What are the key properties of (2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide?
(2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide has a molecular weight of 381.27 g/mol, XLogP of 4.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-bromophenyl)-2-(2-fluorophenyl)-1,3-thiazolidine-3-carboxamide is sourced from PubChem (CID 7297065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).