(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine

C14H15NO2S — CID 686042

IUPAC(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine
SMILESCOc1ccc(N2CCS[C@H]2c2ccco2)cc1
InChIInChI=1S/C14H15NO2S/c1-16-12-6-4-11(5-7-12)15-8-10-18-14(15)13-3-2-9-17-13/h2-7,9,14H,8,10H2,1H3/t14-/m0/s1
InChIKeyKQBZBJLQWXQFTA-AWEZNQCLSA-N
MW261.35 g/mol
LogP3.54
Rot. Bonds3

About (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine

(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine (PubChem CID 686042) has the molecular formula C14H15NO2S and a molecular weight of 261.35 g/mol. Its IUPAC name is (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine.

Molecular Properties

Compound Name(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine
PubChem CID686042
Molecular FormulaC14H15NO2S
Molecular Weight261.35 g/mol
Exact Mass261.08
IUPAC Name(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine
SMILESCOc1ccc(N2CCS[C@H]2c2ccco2)cc1
InChIInChI=1S/C14H15NO2S/c1-16-12-6-4-11(5-7-12)15-8-10-18-14(15)13-3-2-9-17-13/h2-7,9,14H,8,10H2,1H3/t14-/m0/s1
InChIKeyKQBZBJLQWXQFTA-AWEZNQCLSA-N
XLogP3.54
TPSA25.61 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)sulfonyl-1,3-thiazolidine
CID 1084382
[(2S)-2-(furan-2-yl)-1,3-thiazolidin-3-yl]-(3-methoxyphenyl)methanone
CID 7350041
3-(furan-2-yl)-6-(4-methoxyphenyl)-5-sulfanylidene-3,7a-dihydro-1H-imidazo[1,5-c][1,3]thiazol-7-one
CID 5296295
1-[(7R)-7-(furan-2-yl)-1,4-thiazepan-4-yl]-3-(4-methoxyphenyl)propan-1-one
CID 99878870
4-(furan-2-yl)-3-methoxy-1-(4-methoxyphenyl)azetidin-2-one
CID 73312428
[(1R,2R)-2-(furan-2-yl)cyclopropyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 95588006
actinium;(4R)-4-(furan-2-yl)-3-hydroxy-1-(4-methoxyphenyl)azetidin-2-one
CID 59880313
6-(furan-2-yl)-1-(4-methoxyphenyl)-3-(methylamino)-6,7-dihydro-5H-indazol-4-one
CID 16584384
ethyl 3-(4-methoxyphenyl)-1,3-thiazolidine-2-carboxylate
CID 606585
N-(3,5-dimethoxyphenyl)-7-(furan-2-yl)-1,4-thiazepane-4-carboxamide
CID 90632425
diethyl 4-(furan-2-yl)-1-(4-methoxyphenyl)-2,6-dimethyl-4H-pyridine-3,5-dicarboxylate
CID 102432514
(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,2-dihydroquinazolin-4-one
CID 9006450

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine?
The IUPAC name of (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine (CID 686042) is (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine.
What is the SMILES notation for (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine?
The canonical SMILES for (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine is COc1ccc(N2CCS[C@H]2c2ccco2)cc1.
What is the InChIKey of (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine?
The InChIKey is KQBZBJLQWXQFTA-AWEZNQCLSA-N. The full InChI is InChI=1S/C14H15NO2S/c1-16-12-6-4-11(5-7-12)15-8-10-18-14(15)13-3-2-9-17-13/h2-7,9,14H,8,10H2,1H3/t14-/m0/s1.
What are the key properties of (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine?
(2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine has a molecular weight of 261.35 g/mol, XLogP of 3.54, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(furan-2-yl)-3-(4-methoxyphenyl)-1,3-thiazolidine is sourced from PubChem (CID 686042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).