3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine

C22H19NO2S2 — CID 11842232

IUPAC3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine
SMILESO=S(=O)(c1ccc2c(c1)-c1ccccc1C2)N1CCSC1c1ccccc1
InChIInChI=1S/C22H19NO2S2/c24-27(25,23-12-13-26-22(23)16-6-2-1-3-7-16)19-11-10-18-14-17-8-4-5-9-20(17)21(18)15-19/h1-11,15,22H,12-14H2
InChIKeyWZJLZGKZNABKIE-UHFFFAOYSA-N
MW393.53 g/mol
LogP4.69
Rot. Bonds3

About 3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine

3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine (PubChem CID 11842232) has the molecular formula C22H19NO2S2 and a molecular weight of 393.53 g/mol. Its IUPAC name is 3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine.

Molecular Properties

Compound Name3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine
PubChem CID11842232
Molecular FormulaC22H19NO2S2
Molecular Weight393.53 g/mol
Exact Mass393.09
IUPAC Name3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine
SMILESO=S(=O)(c1ccc2c(c1)-c1ccccc1C2)N1CCSC1c1ccccc1
InChIInChI=1S/C22H19NO2S2/c24-27(25,23-12-13-26-22(23)16-6-2-1-3-7-16)19-11-10-18-14-17-8-4-5-9-20(17)21(18)15-19/h1-11,15,22H,12-14H2
InChIKeyWZJLZGKZNABKIE-UHFFFAOYSA-N
XLogP4.69
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.53
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-naphthalen-2-ylsulfonyl-2-phenyl-1,3-thiazolidine
CID 2848104
3-(4-iodophenyl)sulfonyl-2-phenyl-1,3-thiazolidine
CID 3309477
(2S)-3-(4-iodophenyl)sulfonyl-2-phenyl-1,3-thiazolidine
CID 40837132
3-(benzenesulfonyl)-2-pyridin-4-yl-1,3-thiazolidine
CID 3681206
(2R)-3-(4-ethylphenyl)sulfonyl-2-phenyl-1,3-thiazolidine
CID 716649
3-(4-ethylphenyl)sulfonyl-2-phenyl-1,3-thiazolidine
CID 3335512
2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
CID 23938405
(2R)-2-(3-chlorophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
CID 7574021
2-(4-nitrophenyl)-3-(4-phenoxyphenyl)sulfonyl-1,3-thiazolidine
CID 122329683
2-(3-nitrophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
CID 2877097
(2S)-2-(3-nitrophenyl)-3-(4-phenylphenyl)sulfonyl-1,3-thiazolidine
CID 2055915
(2R)-3-naphthalen-1-ylsulfonyl-2-phenyl-1,3-thiazolidine
CID 7272536

Frequently Asked Questions

What is the IUPAC name of 3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine?
The IUPAC name of 3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine (CID 11842232) is 3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine.
What is the SMILES notation for 3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine?
The canonical SMILES for 3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine is O=S(=O)(c1ccc2c(c1)-c1ccccc1C2)N1CCSC1c1ccccc1.
What is the InChIKey of 3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine?
The InChIKey is WZJLZGKZNABKIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO2S2/c24-27(25,23-12-13-26-22(23)16-6-2-1-3-7-16)19-11-10-18-14-17-8-4-5-9-20(17)21(18)15-19/h1-11,15,22H,12-14H2.
What are the key properties of 3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine?
3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine has a molecular weight of 393.53 g/mol, XLogP of 4.69, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(9H-fluoren-3-ylsulfonyl)-2-phenyl-1,3-thiazolidine is sourced from PubChem (CID 11842232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).