phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone

C21H18N2OS — CID 67898559

IUPACphenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone
SMILESO=C(c1ccccc1)N1CCSC1(c1ccccc1)c1ccccn1
InChIInChI=1S/C21H18N2OS/c24-20(17-9-3-1-4-10-17)23-15-16-25-21(23,18-11-5-2-6-12-18)19-13-7-8-14-22-19/h1-14H,15-16H2
InChIKeyUZWYEYVJBSZRTG-UHFFFAOYSA-N
MW346.46 g/mol
LogP4.17
Rot. Bonds3

About phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone

phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone (PubChem CID 67898559) has the molecular formula C21H18N2OS and a molecular weight of 346.46 g/mol. Its IUPAC name is phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone.

Molecular Properties

Compound Namephenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone
PubChem CID67898559
Molecular FormulaC21H18N2OS
Molecular Weight346.46 g/mol
Exact Mass346.11
IUPAC Namephenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone
SMILESO=C(c1ccccc1)N1CCSC1(c1ccccc1)c1ccccn1
InChIInChI=1S/C21H18N2OS/c24-20(17-9-3-1-4-10-17)23-15-16-25-21(23,18-11-5-2-6-12-18)19-13-7-8-14-22-19/h1-14H,15-16H2
InChIKeyUZWYEYVJBSZRTG-UHFFFAOYSA-N
XLogP4.17
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.46
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(2,2-dimethyl-1,3-thiazolidine-3-carbonyl)phenyl]-(2,2-dimethyl-1,3-thiazolidin-3-yl)methanone
CID 67892591
2-pyridin-2-ylthiane-2-carboxylic acid
CID 102543650
(8-naphthalen-2-ylsulfonyl-1-thia-4,8-diazaspiro[4.5]decan-4-yl)-phenylmethanone
CID 5222252
phenyl-[4-(pyridine-4-carbonyl)piperazin-1-yl]methanone
CID 742493
(2R)-3-benzoyl-1'-[(3-fluorophenyl)methyl]-5'-methylspiro[1,3-thiazolidine-2,3'-indole]-2'-one
CID 93186378
1-pyridin-2-ylcyclopropane-1-carboxylic acid;hydrochloride
CID 56604209
1-benzoyl-4-phenylpiperidine-4-carboxylic acid
CID 22240952
europium;pyridine-2-carboxylic acid
CID 174808227
1-benzoyl-2,2-dimethylpyrrolidin-3-one
CID 66936289
phenyl-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]methanone
CID 2090123
3-(4-pyridin-2-ylpiperazine-1-carbonyl)benzoic acid
CID 82183749
phenyl-(4-pyrimidin-2-yl-1,4-diazepan-1-yl)methanone
CID 39998474

Frequently Asked Questions

What is the IUPAC name of phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone?
The IUPAC name of phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone (CID 67898559) is phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone.
What is the SMILES notation for phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone?
The canonical SMILES for phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone is O=C(c1ccccc1)N1CCSC1(c1ccccc1)c1ccccn1.
What is the InChIKey of phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone?
The InChIKey is UZWYEYVJBSZRTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2OS/c24-20(17-9-3-1-4-10-17)23-15-16-25-21(23,18-11-5-2-6-12-18)19-13-7-8-14-22-19/h1-14H,15-16H2.
What are the key properties of phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone?
phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone has a molecular weight of 346.46 g/mol, XLogP of 4.17, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-(2-phenyl-2-pyridin-2-yl-1,3-thiazolidin-3-yl)methanone is sourced from PubChem (CID 67898559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).