(2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone

C15H13ClN2OS — CID 815814

IUPAC(2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone
SMILESO=C(c1ccccc1Cl)N1CCS[C@@H]1c1cccnc1
InChIInChI=1S/C15H13ClN2OS/c16-13-6-2-1-5-12(13)14(19)18-8-9-20-15(18)11-4-3-7-17-10-11/h1-7,10,15H,8-9H2/t15-/m1/s1
InChIKeyCQSJJOBBFGOSGS-OAHLLOKOSA-N
MW304.80 g/mol
LogP3.62
Rot. Bonds2

About (2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone

(2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone (PubChem CID 815814) has the molecular formula C15H13ClN2OS and a molecular weight of 304.80 g/mol. Its IUPAC name is (2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone.

Molecular Properties

Compound Name(2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone
PubChem CID815814
Molecular FormulaC15H13ClN2OS
Molecular Weight304.80 g/mol
Exact Mass304.04
IUPAC Name(2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone
SMILESO=C(c1ccccc1Cl)N1CCS[C@@H]1c1cccnc1
InChIInChI=1S/C15H13ClN2OS/c16-13-6-2-1-5-12(13)14(19)18-8-9-20-15(18)11-4-3-7-17-10-11/h1-7,10,15H,8-9H2/t15-/m1/s1
InChIKeyCQSJJOBBFGOSGS-OAHLLOKOSA-N
XLogP3.62
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.80
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-phenylphenyl)-(2-pyridin-3-yl-1,3-thiazolidin-3-yl)methanone
CID 4129927
(4-nitrophenyl)-(2-pyridin-3-yl-1,3-thiazolidin-3-yl)methanone
CID 5180105
[2-(2-chlorophenyl)-1,3-thiazolidin-3-yl]-(3-fluoro-4-pyridinyl)methanone
CID 122329440
[(2S)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-(2,4-dichlorophenyl)methanone
CID 7438620
(2-chlorophenyl)-[(2S)-2-(5-methylthiophen-2-yl)-1,3-thiazolidin-3-yl]methanone
CID 7397507
[(2S)-2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-(2-methylphenyl)methanone
CID 7360453
[2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-(2-methylphenyl)methanone
CID 4062642
2-[(2S)-2-(4-chlorophenyl)-1,3-thiazolidine-3-carbonyl]benzoic acid
CID 748319
[2-(3-chlorophenyl)-1,3-thiazolidin-3-yl]-pyrazin-2-ylmethanone
CID 122331182
(2-methoxy-3-pyridinyl)-(2-phenyl-1,3-thiazolidin-3-yl)methanone
CID 122329222
[2-(2-chlorophenyl)-1,3-thiazolidin-3-yl]-(2-methoxy-3-pyridinyl)methanone
CID 122329401
(2-chlorophenyl)-(6-methyl-1-pyridin-3-yl-3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 110289094

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone?
The IUPAC name of (2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone (CID 815814) is (2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone.
What is the SMILES notation for (2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone?
The canonical SMILES for (2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone is O=C(c1ccccc1Cl)N1CCS[C@@H]1c1cccnc1.
What is the InChIKey of (2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone?
The InChIKey is CQSJJOBBFGOSGS-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H13ClN2OS/c16-13-6-2-1-5-12(13)14(19)18-8-9-20-15(18)11-4-3-7-17-10-11/h1-7,10,15H,8-9H2/t15-/m1/s1.
What are the key properties of (2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone?
(2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone has a molecular weight of 304.80 g/mol, XLogP of 3.62, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-[(2R)-2-pyridin-3-yl-1,3-thiazolidin-3-yl]methanone is sourced from PubChem (CID 815814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).