3-methyl-1,3-thiazolidin-4-ol;hydrobromide

C4H10BrNOS — CID 172700738

IUPAC3-methyl-1,3-thiazolidin-4-ol;hydrobromide
SMILESBr.CN1CSCC1O
InChIInChI=1S/C4H9NOS.BrH/c1-5-3-7-2-4(5)6;/h4,6H,2-3H2,1H3;1H
InChIKeyCXUSHEGWNXIVBC-UHFFFAOYSA-N
MW200.10 g/mol
LogP0.52
Rot. Bonds

About 3-methyl-1,3-thiazolidin-4-ol;hydrobromide

3-methyl-1,3-thiazolidin-4-ol;hydrobromide (PubChem CID 172700738) has the molecular formula C4H10BrNOS and a molecular weight of 200.10 g/mol. Its IUPAC name is 3-methyl-1,3-thiazolidin-4-ol;hydrobromide.

Molecular Properties

Compound Name3-methyl-1,3-thiazolidin-4-ol;hydrobromide
PubChem CID172700738
Molecular FormulaC4H10BrNOS
Molecular Weight200.10 g/mol
Exact Mass198.97
IUPAC Name3-methyl-1,3-thiazolidin-4-ol;hydrobromide
SMILESBr.CN1CSCC1O
InChIInChI=1S/C4H9NOS.BrH/c1-5-3-7-2-4(5)6;/h4,6H,2-3H2,1H3;1H
InChIKeyCXUSHEGWNXIVBC-UHFFFAOYSA-N
XLogP0.52
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.10
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methyl-1,3-thiazolidin-4-ol;hydrobromide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Thiazolidineethanol
CID 13743632
2-[1-(Dimethylamino)ethylsulfanyl]ethanol
CID 18755319
(5-Methyl-1,3-thiazolidin-3-yl)methanol
CID 20691963
(3-Methyl-1,3-thiazolidin-2-yl)methanol
CID 20699545
(1,3-Thiazolidin-3-yl)methanol
CID 57101744
3-(1-Hydroxyethyl)-1,3-thiazolidine-2-thione
CID 88741845
1-(1,3-Thiazolidin-3-yl)ethanol
CID 89013400
[(2S)-3-methyl-1,3-thiazolidin-2-yl]methanol
CID 90054199
1-(1,3-Thiazolidin-3-yl)propan-1-ol
CID 123722634
4-Hydroxy-3-methyl-1,3-thiazolidine-2-thione
CID 130122041
1-(2-Methyl-1,3-thiazolidin-3-yl)ethanol
CID 153684583
3-Methyl-1,3-thiazolidin-2-ol
CID 153684768

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1,3-thiazolidin-4-ol;hydrobromide?
The IUPAC name of 3-methyl-1,3-thiazolidin-4-ol;hydrobromide (CID 172700738) is 3-methyl-1,3-thiazolidin-4-ol;hydrobromide.
What is the SMILES notation for 3-methyl-1,3-thiazolidin-4-ol;hydrobromide?
The canonical SMILES for 3-methyl-1,3-thiazolidin-4-ol;hydrobromide is Br.CN1CSCC1O.
What is the InChIKey of 3-methyl-1,3-thiazolidin-4-ol;hydrobromide?
The InChIKey is CXUSHEGWNXIVBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NOS.BrH/c1-5-3-7-2-4(5)6;/h4,6H,2-3H2,1H3;1H.
What are the key properties of 3-methyl-1,3-thiazolidin-4-ol;hydrobromide?
3-methyl-1,3-thiazolidin-4-ol;hydrobromide has a molecular weight of 200.10 g/mol, XLogP of 0.52, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1,3-thiazolidin-4-ol;hydrobromide is sourced from PubChem (CID 172700738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).